Oprea1_029139
4-fluoro-N-[2-[3-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanylindol-1-yl]ethyl]benzamide
Also Known As: Oprea1_029139|F0554-0325|SR-01000544277-1|4-fluoro-N-(2-(3-((2-oxo-2-(thiazol-2-ylamino)ethyl)thio)-1H-indol-1-yl)ethyl)benzamide|4-fluoro-N-{2-[3-({[(1,3-thiazol-2-yl)carbamoyl]methyl}sulfanyl)-1H-indol-1-yl]ethyl}benzamide|4-fluoro-N-[2-[3-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanylindol-1-yl]ethyl]benzamide|4-fluoro-N-[2-[3-(1,3-thiazol-2-ylcarbamoylmethylsulfanyl)indol-1-yl]ethyl]benzamide|N-(2-{3-[(N-1,3-thiazol-2-ylcarbamoyl)methylthio]-1-indolyl}ethyl)p-fluorobenzamide
| Molecular Formula | C22H19FN4O2S2 |
|---|---|
| Molecular Weight | 454.09335 g/mol |
| LogP | 4.3977 |
| Topological Polar Surface Area | 76.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 454.09335 |
| Monoisotopic Mass | 454.09335 |
| Heavy Atoms | 31 |
| Complexity | 1190.1853 |
Chemical Identifiers
| CAS Number | 443333-37-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2CCNC(=O)C3=CC=C(C=C3)F)SCC(=O)NC4=NC=CS4 |
Product Overview
Oprea1_029139 (CAS 443333-37-7), with molecular formula C22H19FN4O2S2 and molecular weight 454.09335 g/mol. IUPAC: 4-fluoro-N-[2-[3-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]sulfanylindol-1-yl]ethyl]benzamide.
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