Propanedioic acid,2-(acetylamino)-2-[(5-nitro-1H-indol-3-yl)methyl]-, 1,3-diethyl ester
Modify Date: 2026-08-09 09:53:19
![Propanedioic acid,2-(acetylamino)-2-[(5-nitro-1H-indol-3-yl)methyl]-, 1,3-diethyl ester Structure](https://image.chemsrc.com/caspic/334/6958-33-4.png)
Propanedioic acid,2-(acetylamino)-2-[(5-nitro-1H-indol-3-yl)methyl]-, 1,3-diethyl ester structure
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Common Name | Propanedioic acid,2-(acetylamino)-2-[(5-nitro-1H-indol-3-yl)methyl]-, 1,3-diethyl ester | ||
|---|---|---|---|---|
| CAS Number | 6958-33-4 | Molecular Weight | 391.37500 | |
| Density | 1.342g/cm3 | Boiling Point | 615.8ºC at 760mmHg | |
| Molecular Formula | C18H21N3O7 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 326.2ºC | |
| Name | diethyl 2-acetamido-2-[(5-nitro-1H-indol-3-yl)methyl]propanedioate |
|---|---|
| Synonym | More Synonyms |
| Density | 1.342g/cm3 |
|---|---|
| Boiling Point | 615.8ºC at 760mmHg |
| Molecular Formula | C18H21N3O7 |
| Molecular Weight | 391.37500 |
| Flash Point | 326.2ºC |
| Exact Mass | 391.13800 |
| PSA | 143.31000 |
| LogP | 2.53380 |
| Index of Refraction | 1.655 |
| InChIKey | IINRGTWFETXCNC-UHFFFAOYSA-N |
| SMILES | CCOC(=O)C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)(NC(C)=O)C(=O)OCC |
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Propanedioic ac... CAS#:6958-33-4 |
| Literature: Cavallini; Ravenna Farmaco, Edizione Scientifica, 1958 , vol. 13, p. 105,109 |
| Precursor 2 | |
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| DownStream 1 | |
![Propanedioic acid,2-(acetylamino)-2-[(5-amino-1H-indol-3-yl)methyl]-, 1,3-diethyl ester structure](https://image.chemsrc.com/caspic/230/6952-16-5.png)
CAS#:6952-16-5|
Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
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Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
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External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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Name: qHTS for Inhibitors of human tyrosyl-DNA phosphodiesterase 1 (TDP1): qHTS in cells in...
Source: NCGC
Target: TDP1 protein [Homo sapiens]
External Id: TDP1100
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Name: qHTS for Inhibitors of human tyrosyl-DNA phosphodiesterase 1 (TDP1): qHTS in cells in...
Source: NCGC
Target: TDP1 protein [Homo sapiens]
External Id: TDP1101
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Name: Schnurri-3 Inhibitors: specific inducers of adult bone formation Measured in Cell-Bas...
Source: Broad Institute
Target: N/A
External Id: 2134-01_Inhibitor_SinglePoint_HTS_Activity_Set2
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Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
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Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
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Name: High throughput screen for small molecule inhibitors of a hypoxia-regulated fluoresce...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
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External Id: HMS1149-MLP
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Name: qHTS for Inhibitors of AMA1-RON; Towards Development of Antimalarial Drug Lead: Prima...
Source: NCGC
Target: apical membrane antigen 1, AMA1 [Plasmodium falciparum 3D7]
External Id: AMA1100
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