AC1LHLW6
methyl 2-(pyridine-3-carbonylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Also Known As: Oprea1_870577|AB00093923-01|AK-968/37129132|methyl 2-(pyridine-3-amido)-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxylate|methyl 2-(pyridine-3-carbonylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate|methyl 2-[(3-pyridinylcarbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate|methyl 2-(nicotinamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate|methyl 2-(3-pyridylcarbonylamino)-4,5,6,7,8-pentahydrocyclohepta[2,1-b]thiophe ne-3-carboxylate|methyl 2-[(pyridin-3-ylcarbonyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
| Molecular Formula | C17H18N2O3S |
|---|---|
| Molecular Weight | 330.10382 g/mol |
| LogP | 3.4509 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.10382 |
| Monoisotopic Mass | 330.10382 |
| Heavy Atoms | 23 |
| Complexity | 724.93976 |
Chemical Identifiers
| CAS Number | 354546-77-3 |
|---|---|
| SMILES | COC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=CN=CC=C3 |
Product Overview
AC1LHLW6 (CAS 354546-77-3), with molecular formula C17H18N2O3S and molecular weight 330.10382 g/mol. IUPAC: methyl 2-(pyridine-3-carbonylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate.