AC1LKMHB
propan-2-yl 4-methyl-5-[(2-methylphenyl)carbamoyl]-2-(pyridine-4-carbonylamino)thiophene-3-carboxylate
Also Known As: Oprea1_265442|AK-968/40709855|isopropyl 2-(isonicotinoylamino)-4-methyl-5-(2-toluidinocarbonyl)thiophene-3-carboxylate|propan-2-yl 4-methyl-5-[(2-methylphenyl)carbamoyl]-2-(pyridine-4-carbonylamino)thiophene-3-carboxylate|isopropyl 2-(isonicotinamido)-4-methyl-5-(o-tolylcarbamoyl)thiophene-3-carboxylate|ISOPROPYL 4-METHYL-2-[(4-PYRIDYLCARBONYL)AMINO]-5-(2-TOLUIDINOCARBONYL)-3-THIOPHENECARBOXYLATE|propan-2-yl 4-methyl-5-[(2-methylphenyl)carbamoyl]-2-[(pyridin-4-ylcarbonyl)amino]thiophene-3-carboxylate
| Molecular Formula | C23H23N3O4S |
|---|---|
| Molecular Weight | 437.14093 g/mol |
| LogP | 4.82974 |
| Topological Polar Surface Area | 97.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 437.14093 |
| Monoisotopic Mass | 437.14093 |
| Heavy Atoms | 31 |
| Complexity | 1123.1052 |
Chemical Identifiers
| CAS Number | 445013-76-3 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)C2=C(C(=C(S2)NC(=O)C3=CC=NC=C3)C(=O)OC(C)C)C |
Product Overview
AC1LKMHB (CAS 445013-76-3), with molecular formula C23H23N3O4S and molecular weight 437.14093 g/mol. IUPAC: propan-2-yl 4-methyl-5-[(2-methylphenyl)carbamoyl]-2-(pyridine-4-carbonylamino)thiophene-3-carboxylate.