AC1LDKP0
2-[(3,4-dimethylbenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Also Known As: Oprea1_027134|2-(3,4-dimethylbenzamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide|AB00672576-01|AK-968/12100002|2-[(3,4-dimethylbenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide|F0806-0400|2-(3,4-DIMETHYLBENZAMIDO)-4H,5H,6H,7H,8H-CYCLOHEPTA[B]THIOPHENE-3-CARBOXAMIDE|2-{[(3,4-dimethylphenyl)carbonyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide|2-[(3,4-dimethylphenyl)carbonylamino]-4,5,6,7,8-pentahydrocyclohepta[2,1-b]thi ophene-3-carboxamide
| Molecular Formula | C19H22N2O2S |
|---|---|
| Molecular Weight | 342.1402 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 342.1402 |
| Monoisotopic Mass | 342.1402 |
| Heavy Atoms | 24 |
| Complexity | 484.0 |
Chemical Identifiers
| CAS Number | 321532-71-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)N)C |
| InChIKey | CXMPWDKLMNVJQB-UHFFFAOYSA-N |
Product Overview
AC1LDKP0 (CAS 321532-71-2), with molecular formula C19H22N2O2S and molecular weight 342.1402 g/mol. IUPAC: 2-[(3,4-dimethylbenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide.
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