5-(azepane-1-carbonyl)-N,N-diethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
5-(azepane-1-carbonyl)-N,N-diethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
5-(azepane-1-carbonyl)-N,N-diethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | T408-1695 |
| Compound Name: | 5-(azepane-1-carbonyl)-N,N-diethyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 362.53 |
| Molecular Formula: | C20 H30 N2 O2 S |
| Smiles: | CCN(CC)C(c1cc2CC(CCc2s1)C(N1CCCCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7068 |
| logD: | 3.7068 |
| logSw: | -3.7782 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.089 |
| InChI Key: | YIDFDNOSDQUDJR-OAHLLOKOSA-N |