2-[4-(4-cyanobenzoyl)piperazin-1-yl]-N-[(thiophen-2-yl)methyl]pyridine-3-carboxamide
Chemical Structure Depiction of
2-[4-(4-cyanobenzoyl)piperazin-1-yl]-N-[(thiophen-2-yl)methyl]pyridine-3-carboxamide
2-[4-(4-cyanobenzoyl)piperazin-1-yl]-N-[(thiophen-2-yl)methyl]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | V017-9068 |
| Compound Name: | 2-[4-(4-cyanobenzoyl)piperazin-1-yl]-N-[(thiophen-2-yl)methyl]pyridine-3-carboxamide |
| Molecular Weight: | 431.52 |
| Molecular Formula: | C23 H21 N5 O2 S |
| Salt: | not_available |
| Smiles: | [H]C1([H])CN(CC([H])([H])N1C(c1ccc(C#N)cc1)=O)c1c(cccn1)C(NCc1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8085 |
| logD: | 2.808 |
| logSw: | -3.5797 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.616 |
| InChI Key: | WVBJJWJXEAMVOA-UHFFFAOYSA-N |