N-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]ethyl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
N-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]ethyl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
N-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]ethyl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | C760-0496 |
| Compound Name: | N-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]ethyl}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 418 |
| Molecular Formula: | C22 H28 Cl N3 O S |
| Smiles: | Cc1ccc(cc1N1CCN(CCNC(c2csc3CCCCc23)=O)CC1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.0785 |
| logD: | 4.9655 |
| logSw: | -5.0485 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.374 |
| InChI Key: | YFEFWHVALCTEBA-UHFFFAOYSA-N |