N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Chemical Structure Depiction of
N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Compound characteristics
| Compound ID: | C760-1050 |
| Compound Name: | N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide |
| Molecular Weight: | 415.57 |
| Molecular Formula: | C23 H30 F N3 O S |
| Smiles: | C1CCc2c(csc2CC1)C(NCCCN1CCN(CC1)c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5935 |
| logD: | 4.2923 |
| logSw: | -4.2978 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.705 |
| InChI Key: | RWKXFQIMSNRORB-UHFFFAOYSA-N |