AC1NP42Z
N-[2-[3-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-4-fluorobenzamide
Also Known As: Oprea1_052245|F0554-0326|N-(2-(3-((2-(benzo[d]thiazol-2-ylamino)-2-oxoethyl)thio)-1H-indol-1-yl)ethyl)-4-fluorobenzamide|N-{2-[3-({[(1,3-benzothiazol-2-yl)carbamoyl]methyl}sulfanyl)-1H-indol-1-yl]ethyl}-4-fluorobenzamide|N-[2-[3-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-4-fluorobenzamide|N-[2-[3-(benzothiazol-2-ylcarbamoylmethylsulfanyl)indol-1-yl]ethyl]-4-fluoro-benzamide
| Molecular Formula | C26H21FN4O2S2 |
|---|---|
| Molecular Weight | 504.109 g/mol |
| LogP | 5.5509 |
| Topological Polar Surface Area | 76.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 504.109 |
| Monoisotopic Mass | 504.109 |
| Heavy Atoms | 35 |
| Complexity | 1478.1704 |
Chemical Identifiers
| CAS Number | 532972-18-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2CCNC(=O)C3=CC=C(C=C3)F)SCC(=O)NC4=NC5=CC=CC=C5S4 |
Product Overview
AC1NP42Z (CAS 532972-18-2), with molecular formula C26H21FN4O2S2 and molecular weight 504.109 g/mol. IUPAC: N-[2-[3-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-4-fluorobenzamide.
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