2-amino-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide structure
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Common Name | 2-amino-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide | ||
|---|---|---|---|---|
| CAS Number | 40106-15-8 | Molecular Weight | 224.32300 | |
| Density | 1.231g/cm3 | Boiling Point | 362.5ºC at 760 mmHg | |
| Molecular Formula | C11H16N2OS | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 173ºC | |
| Name | 2-amino-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide |
|---|
| Density | 1.231g/cm3 |
|---|---|
| Boiling Point | 362.5ºC at 760 mmHg |
| Molecular Formula | C11H16N2OS |
| Molecular Weight | 224.32300 |
| Flash Point | 173ºC |
| Exact Mass | 224.09800 |
| PSA | 97.35000 |
| LogP | 3.36970 |
| Index of Refraction | 1.617 |
| InChIKey | XZCZLVCNYYVFKH-UHFFFAOYSA-N |
| SMILES | NC(=O)c1c(N)sc2c1CCCCCC2 |
| Hazard Codes | Xi |
|---|---|
| HS Code | 2934999090 |
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~54%
2-amino-4,5,6,7... CAS#:40106-15-8 |
| Literature: Nallangi, Radhika; Samala, Ganesh; Sridevi, Jonnalagadda Padma; Yogeeswari, Perumal; Sriram, Dharmarajan European Journal of Medicinal Chemistry, 2014 , vol. 76, p. 110 - 117 |
|
~53%
2-amino-4,5,6,7... CAS#:40106-15-8 |
| Literature: Masaoka, Takashi; Chung, Suhman; Caboni, Pierluigi; Rausch, Jason W.; Wilson, Jennifer A.; Taskent-Sezgin, Humeyra; Beutler, John A.; Tocco, Graziella; Le Grice, Stuart F. J. Journal of Medicinal Chemistry, 2013 , vol. 56, # 13 p. 5436 - 5445 |
|
~%
2-amino-4,5,6,7... CAS#:40106-15-8 |
| Literature: Aurelio, Luigi; Christopoulos, Arthur; Flynn, Bernard L.; Scammells, Peter J.; Sexton, Patrick M.; Valant, Celine Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 12 p. 3704 - 3707 |
|
~%
2-amino-4,5,6,7... CAS#:40106-15-8 |
| Literature: Kassab, Asmaa E.; Gedawy, Ehab M. European Journal of Medicinal Chemistry, 2013 , vol. 63, p. 224 - 230 |
| Precursor 3 | |
|---|---|
| DownStream 0 | |
| HS Code | 2934999090 |
|---|---|
| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Name: Allosteric modulation at human adenosine A1 receptor expressed in CHO FlpIn cells ass...
Source: ChEMBL
Target: Adenosine receptor A1
External Id: CHEMBL1781654
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Name: Allosteric modulation at human adenosine A1 receptor expressed in CHO FlpIn cells ass...
Source: ChEMBL
Target: Adenosine receptor A1
External Id: CHEMBL1781653
|
|
Name: Allosteric modulation at human adenosine A1 receptor expressed in CHO FlpIn cells ass...
Source: ChEMBL
Target: Adenosine receptor A1
External Id: CHEMBL1781655
|
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Name: Contractile Force Screening of ChemBridge Diverset library for asthma drug discovery
Source: 24015
Target: N/A
External Id: HSPH_Screening_CFS_002
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|
Name: Cell-based high throughput primary assay to identify activators of GPR151
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id: GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
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Name: Inhibition of RNase H activity of HIV-1 HXB2 reverse transcriptase p66/p51 after 10 m...
Source: ChEMBL
Target: Reverse transcriptase/RNaseH
External Id: CHEMBL1678146
|
|
Name: AlphaScreen-based biochemical high throughput primary assay to identify activators of...
Source: The Scripps Research Institute Molecular Screening Center
Target: N/A
External Id: FBW7_ACT_ALPHA_1536_1X%ACT PRUN
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Name: AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
Source: The Scripps Research Institute Molecular Screening Center
External Id: MITF_INH_Alpha_1536_1X%INH PRUN
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