N-[3-(4-benzylpiperazin-1-yl)propyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Chemical Structure Depiction of
N-[3-(4-benzylpiperazin-1-yl)propyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
N-[3-(4-benzylpiperazin-1-yl)propyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Compound characteristics
| Compound ID: | C760-1055 |
| Compound Name: | N-[3-(4-benzylpiperazin-1-yl)propyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide |
| Molecular Weight: | 411.61 |
| Molecular Formula: | C24 H33 N3 O S |
| Smiles: | C1CCc2c(csc2CC1)C(NCCCN1CCN(CC1)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0961 |
| logD: | 3.3252 |
| logSw: | -4.1523 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.286 |
| InChI Key: | ITOSMRHQVXSDLX-UHFFFAOYSA-N |