AC1NEG98
N-[2-[3-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanylindol-1-yl]ethyl]-4-fluorobenzamide
Also Known As: SR-01000544276-1|F0554-0324|N-(2-{3-[({[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}methyl)sulfanyl]-1H-indol-1-yl}ethyl)-4-fluorobenzamide|N-(2-(3-((2-((2-chloro-5-(trifluoromethyl)phenyl)amino)-2-oxoethyl)thio)-1H-indol-1-yl)ethyl)-4-fluorobenzamide|N-[2-[3-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanylindol-1-yl]ethyl]-4-fluorobenzamide
| Molecular Formula | C26H20ClF4N3O2S |
|---|---|
| Molecular Weight | 549.0901 g/mol |
| LogP | 6.6134 |
| Topological Polar Surface Area | 63.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 549.0901 |
| Monoisotopic Mass | 549.0901 |
| Heavy Atoms | 37 |
| Complexity | 1438.2836 |
Chemical Identifiers
| CAS Number | 443333-36-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2CCNC(=O)C3=CC=C(C=C3)F)SCC(=O)NC4=C(C=CC(=C4)C(F)(F)F)Cl |
Product Overview
AC1NEG98 (CAS 443333-36-6), with molecular formula C26H20ClF4N3O2S and molecular weight 549.0901 g/mol. IUPAC: N-[2-[3-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanylindol-1-yl]ethyl]-4-fluorobenzamide.
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