Thiocarlide
Thiocarlide structure
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Common Name | Thiocarlide | ||
|---|---|---|---|---|
| CAS Number | 910-86-1 | Molecular Weight | 400.577 | |
| Density | 1.1±0.1 g/cm3 | Boiling Point | 508.5±60.0 °C at 760 mmHg | |
| Molecular Formula | C23H32N2O2S | Melting Point | 134-145° | |
| MSDS | N/A | Flash Point | 261.3±32.9 °C | |
Use of ThiocarlideThiocarlide (isoxyl) is a thiourea derivative that was used in the 1960s to successfully treat tuberculosis (TB). |
| Name | 1,3-bis[4-(3-methylbutoxy)phenyl]thiourea |
|---|---|
| Synonym | More Synonyms |
| Density | 1.1±0.1 g/cm3 |
|---|---|
| Boiling Point | 508.5±60.0 °C at 760 mmHg |
| Melting Point | 134-145° |
| Molecular Formula | C23H32N2O2S |
| Molecular Weight | 400.577 |
| Flash Point | 261.3±32.9 °C |
| Exact Mass | 400.218445 |
| PSA | 74.61000 |
| LogP | 6.12 |
| Vapour Pressure | 0.0±1.3 mmHg at 25°C |
| Index of Refraction | 1.600 |
| InChIKey | BWBONKHPVHMQHE-UHFFFAOYSA-N |
| SMILES | CC(C)CCOc1ccc(NC(=S)Nc2ccc(OCCC(C)C)cc2)cc1 |
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~50%
Thiocarlide CAS#:910-86-1 |
| Literature: Brown, Joshua R.; North, Elton J.; Hurdle, Julian G.; Morisseau, Christophe; Scarborough, Jerrod S.; Sun, Dianqing; Kordulakova, Jana; Scherman, Michael S.; Jones, Victoria; Grzegorzewicz, Anna; Crew, Rebecca M.; Jackson, Mary; McNeil, Michael R.; Lee, Richard E. Bioorganic and Medicinal Chemistry, 2011 , vol. 19, # 18 p. 5585 - 5595 |
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~54%
Thiocarlide CAS#:910-86-1 |
| Literature: Bhowruth, Veemal; Brown, Alistair K.; Reynolds, Robert C.; Coxon, Geoffrey D.; Mackay, Simon P.; Minnikin, David E.; Besra, Gurdyal S. Bioorganic and Medicinal Chemistry Letters, 2006 , vol. 16, # 18 p. 4743 - 4747 |
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Thiocarlide CAS#:910-86-1 |
| Literature: Brown, Joshua R.; North, Elton J.; Hurdle, Julian G.; Morisseau, Christophe; Scarborough, Jerrod S.; Sun, Dianqing; Kordulakova, Jana; Scherman, Michael S.; Jones, Victoria; Grzegorzewicz, Anna; Crew, Rebecca M.; Jackson, Mary; McNeil, Michael R.; Lee, Richard E. Bioorganic and Medicinal Chemistry, 2011 , vol. 19, # 18 p. 5585 - 5595 |
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~%
Thiocarlide CAS#:910-86-1 |
| Literature: Brown, Joshua R.; North, Elton J.; Hurdle, Julian G.; Morisseau, Christophe; Scarborough, Jerrod S.; Sun, Dianqing; Kordulakova, Jana; Scherman, Michael S.; Jones, Victoria; Grzegorzewicz, Anna; Crew, Rebecca M.; Jackson, Mary; McNeil, Michael R.; Lee, Richard E. Bioorganic and Medicinal Chemistry, 2011 , vol. 19, # 18 p. 5585 - 5595 |
|
~%
Thiocarlide CAS#:910-86-1 |
| Literature: Brown, Joshua R.; North, Elton J.; Hurdle, Julian G.; Morisseau, Christophe; Scarborough, Jerrod S.; Sun, Dianqing; Kordulakova, Jana; Scherman, Michael S.; Jones, Victoria; Grzegorzewicz, Anna; Crew, Rebecca M.; Jackson, Mary; McNeil, Michael R.; Lee, Richard E. Bioorganic and Medicinal Chemistry, 2011 , vol. 19, # 18 p. 5585 - 5595 |
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~%
Thiocarlide CAS#:910-86-1 |
| Literature: CIBA Patent: US2703815 , 1951 ; Full Text Show Details CIBA Patent: DE923446 , 1952 ; |
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Name: Antibacterial activity against Mycobacterium bovis (BCG); value ranges from 0.5-1
Source: ChEMBL
Target: Mycobacterium tuberculosis variant bovis
External Id: CHEMBL745314
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Name: Antibacterial activity against Staphylococcus aureus
Source: ChEMBL
Target: Staphylococcus aureus
External Id: CHEMBL1819925
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Name: Antitubercular activity against Mycobacterium avium
Source: ChEMBL
Target: Mycobacterium avium
External Id: CHEMBL987021
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Name: Antibacterial activity against Bacillus anthracis
Source: ChEMBL
Target: Bacillus anthracis
External Id: CHEMBL1819924
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Name: Antitubercular activity against Mycobacterium bovis BCG
Source: ChEMBL
Target: Mycobacterium tuberculosis
External Id: CHEMBL987020
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Name: Antibacterial activity against Escherichia coli K12
Source: ChEMBL
Target: Escherichia coli
External Id: CHEMBL1819927
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Name: Antibacterial activity against Escherichia coli expressing TolC
Source: ChEMBL
Target: Escherichia coli
External Id: CHEMBL1819926
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Name: Antimycobacterial activity against Mycobacterium bovis BCG NCTC 5692
Source: ChEMBL
Target: Mycobacterium tuberculosis
External Id: CHEMBL914572
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Name: Antibacterial activity against Mycobacterium tuberculosis H37Rv
Source: ChEMBL
Target: Mycobacterium tuberculosis
External Id: CHEMBL909164
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Name: Antitubercular activity against Mycobacterium aurum A1
Source: ChEMBL
Target: Mycolicibacterium aurum
External Id: CHEMBL987022
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| Tiocarlida |
| 4-13-00-01187 (Beilstein Handbook Reference) |
| Sarbamyl |
| Thiocarlide |
| 1,3-Bis(p-isoamyloxyphenyl)-2-thiourea |
| 4,4'-Di(isoamyloxy)thiocarbanilide |
| Amixyl |
| Tiocarlid |
| DATC |
| 1,3-Bis[4-(3-methylbutoxy)phenyl]thiourea |
| Thiourea, N,N'-bis(4-(3-methylbutoxy)phenyl)- (9CI) |
| Tiocarlidum |
| Disoxyl |
| tiocarlide |
| N,N'-[4-(3-Methylbutoxy)phenyl]thiourea |
| Isoxyl |