N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Chemical Structure Depiction of
N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Compound characteristics
| Compound ID: | C760-1077 |
| Compound Name: | N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide |
| Molecular Weight: | 411.61 |
| Molecular Formula: | C24 H33 N3 O S |
| Smiles: | Cc1cccc(c1C)N1CCN(CCNC(c2csc3CCCCCc23)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 5.4154 |
| logD: | 5.3024 |
| logSw: | -5.1428 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.705 |
| InChI Key: | HEIXNSGZDRHZQP-UHFFFAOYSA-N |