AC1MQJPX
N-[2-[3-[2-(2,5-dimethylanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]thiophene-2-carboxamide
Also Known As: Oprea1_506217|F0554-0944|SR-01000544311-1|N-{2-[3-({[(2,5-dimethylphenyl)carbamoyl]methyl}sulfanyl)-1H-indol-1-yl]ethyl}thiophene-2-carboxamide|N-(2-(3-((2-((2,5-dimethylphenyl)amino)-2-oxoethyl)thio)-1H-indol-1-yl)ethyl)thiophene-2-carboxamide|N-[2-[3-[2-(2,5-dimethylanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]thiophene-2-carboxamide|N-(2-{3-[(N-2,5-xylylcarbamoyl)methylthio]-1-indolyl}ethyl)-2-thenamide|N-[2-[3-[(2,5-dimethylphenyl)carbamoylmethylsulfanyl]indol-1-yl]ethyl]thiophene-2-carboxamide
| Molecular Formula | C25H25N3O2S2 |
|---|---|
| Molecular Weight | 463.13882 g/mol |
| LogP | 5.48044 |
| Topological Polar Surface Area | 63.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 463.13882 |
| Monoisotopic Mass | 463.13882 |
| Heavy Atoms | 32 |
| Complexity | 1245.5559 |
Chemical Identifiers
| CAS Number | 443333-72-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)NC(=O)CSC2=CN(C3=CC=CC=C32)CCNC(=O)C4=CC=CS4 |
Product Overview
AC1MQJPX (CAS 443333-72-0), with molecular formula C25H25N3O2S2 and molecular weight 463.13882 g/mol. IUPAC: N-[2-[3-[2-(2,5-dimethylanilino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]thiophene-2-carboxamide.