AC1LWTWG
propan-2-yl 2-[(2-chloropyridine-3-carbonyl)amino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
Also Known As: Oprea1_573655|AK-968/40729176|isopropyl 2-{[(2-chloro-3-pyridinyl)carbonyl]amino}-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate|propan-2-yl 2-[(2-chloropyridine-3-carbonyl)amino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate|isopropyl 2-(2-chloronicotinamido)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate|ISOPROPYL 2-{[(2-CHLORO-3-PYRIDYL)CARBONYL]AMINO}-4,5,6,7,8,9,10,11,12,13-DECAHYDROCYCLODODECA[B]THIOPHENE-3-CARBOXYLATE|propan-2-yl 2-{[(2-chloropyridin-3-yl)carbonyl]amino}-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
| Molecular Formula | C24H31ClN2O3S |
|---|---|
| Molecular Weight | 462.17438 g/mol |
| LogP | 6.8334 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 462.17438 |
| Monoisotopic Mass | 462.17438 |
| Heavy Atoms | 31 |
| Complexity | 910.22455 |
Chemical Identifiers
| CAS Number | 445016-41-1 |
|---|---|
| SMILES | CC(C)OC(=O)C1=C(SC2=C1CCCCCCCCCC2)NC(=O)C3=C(N=CC=C3)Cl |
Product Overview
AC1LWTWG (CAS 445016-41-1), with molecular formula C24H31ClN2O3S and molecular weight 462.17438 g/mol. IUPAC: propan-2-yl 2-[(2-chloropyridine-3-carbonyl)amino]-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate.
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