N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[4-(2-chloro-6-methoxypyridine-4-carbonyl)piperazin-1-yl]pyridine-3-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[4-(2-chloro-6-methoxypyridine-4-carbonyl)piperazin-1-yl]pyridine-3-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[4-(2-chloro-6-methoxypyridine-4-carbonyl)piperazin-1-yl]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | V007-0813 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[4-(2-chloro-6-methoxypyridine-4-carbonyl)piperazin-1-yl]pyridine-3-carboxamide |
| Molecular Weight: | 509.95 |
| Molecular Formula: | C25 H24 Cl N5 O5 |
| Salt: | not_available |
| Smiles: | [H]C1([H])CN(CC([H])([H])N1C(c1cc(nc(c1)[Cl])OC)=O)c1c(cccn1)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.296 |
| logD: | 3.2956 |
| logSw: | -3.7938 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.584 |
| InChI Key: | CCXLMEMEPLTBGA-UHFFFAOYSA-N |