AC1N5LYX
N-[2-[3-[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-4-fluorobenzamide
Also Known As: Oprea1_272904|SR-01000544292-1|F0554-0341|N-{2-[3-({[(2,4-dimethoxyphenyl)carbamoyl]methyl}sulfanyl)-1H-indol-1-yl]ethyl}-4-fluorobenzamide|N-[2-[3-[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-4-fluorobenzamide|N-(2-(3-((2-((2,4-dimethoxyphenyl)amino)-2-oxoethyl)thio)-1H-indol-1-yl)ethyl)-4-fluorobenzamide|N-[2-[3-[(2,4-dimethoxyphenyl)carbamoylmethylsulfanyl]indol-1-yl]ethyl]-4-fluoro-benzamide
| Molecular Formula | C27H26FN3O4S |
|---|---|
| Molecular Weight | 507.1628 g/mol |
| LogP | 4.9584 |
| Topological Polar Surface Area | 81.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 507.1628 |
| Monoisotopic Mass | 507.1628 |
| Heavy Atoms | 36 |
| Complexity | 1371.464 |
Chemical Identifiers
| CAS Number | 443333-52-6 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)NC(=O)CSC2=CN(C3=CC=CC=C32)CCNC(=O)C4=CC=C(C=C4)F)OC |
Product Overview
AC1N5LYX (CAS 443333-52-6), with molecular formula C27H26FN3O4S and molecular weight 507.1628 g/mol. IUPAC: N-[2-[3-[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]-4-fluorobenzamide.
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