2-[4-(4-cyanobenzoyl)piperazin-1-yl]-N-[(4-methoxyphenyl)methyl]pyridine-3-carboxamide
Chemical Structure Depiction of
2-[4-(4-cyanobenzoyl)piperazin-1-yl]-N-[(4-methoxyphenyl)methyl]pyridine-3-carboxamide
2-[4-(4-cyanobenzoyl)piperazin-1-yl]-N-[(4-methoxyphenyl)methyl]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | V006-0766 |
| Compound Name: | 2-[4-(4-cyanobenzoyl)piperazin-1-yl]-N-[(4-methoxyphenyl)methyl]pyridine-3-carboxamide |
| Molecular Weight: | 455.52 |
| Molecular Formula: | C26 H25 N5 O3 |
| Salt: | not_available |
| Smiles: | [H]C1([H])CN(CC([H])([H])N1C(c1ccc(C#N)cc1)=O)c1c(cccn1)C(NCc1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8158 |
| logD: | 2.8154 |
| logSw: | -3.3463 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.141 |
| InChI Key: | INBNIKVGCWQMQC-UHFFFAOYSA-N |