AC1MPR0X
N-[4-(4-tert-butylphenyl)-3-carbamoyl-5-methylthiophen-2-yl]-2-chloropyridine-3-carboxamide
Also Known As: Oprea1_428638|AK-968/40642745|N-[4-(4-tert-butylphenyl)-3-carbamoyl-5-methylthiophen-2-yl]-2-chloropyridine-3-carboxamide|N-[3-(aminocarbonyl)-4-(4-tert-butylphenyl)-5-methylthien-2-yl]-2-chloronicotinamide|N-[3-carbamoyl-5-methyl-4-(4-tert-butylphenyl)thiophen-2-yl]-2-chloro-pyridine-3-carboxamide|N-{3-(AMINOCARBONYL)-4-[4-(TERT-BUTYL)PHENYL]-5-METHYL-2-THIENYL}-2-CHLORONICOTINAMIDE
| Molecular Formula | C22H22ClN3O2S |
|---|---|
| Molecular Weight | 427.11212 g/mol |
| LogP | 5.42062 |
| Topological Polar Surface Area | 85.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 427.11212 |
| Monoisotopic Mass | 427.11212 |
| Heavy Atoms | 29 |
| Complexity | 1082.4271 |
Chemical Identifiers
| CAS Number | 445002-49-3 |
|---|---|
| SMILES | CC1=C(C(=C(S1)NC(=O)C2=C(N=CC=C2)Cl)C(=O)N)C3=CC=C(C=C3)C(C)(C)C |
Product Overview
AC1MPR0X (CAS 445002-49-3), with molecular formula C22H22ClN3O2S and molecular weight 427.11212 g/mol. IUPAC: N-[4-(4-tert-butylphenyl)-3-carbamoyl-5-methylthiophen-2-yl]-2-chloropyridine-3-carboxamide.
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