N-{2-[4-(2-chloro-6-methoxypyridine-4-carbonyl)piperazin-1-yl]pyridin-3-yl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{2-[4-(2-chloro-6-methoxypyridine-4-carbonyl)piperazin-1-yl]pyridin-3-yl}-2H-1,3-benzodioxole-5-carboxamide
N-{2-[4-(2-chloro-6-methoxypyridine-4-carbonyl)piperazin-1-yl]pyridin-3-yl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V031-0846 |
| Compound Name: | N-{2-[4-(2-chloro-6-methoxypyridine-4-carbonyl)piperazin-1-yl]pyridin-3-yl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 495.92 |
| Molecular Formula: | C24 H22 Cl N5 O5 |
| Salt: | not_available |
| Smiles: | COc1cc(cc(n1)[Cl])C(N1CCN(CC1)c1c(cccn1)NC(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2722 |
| logD: | 3.2568 |
| logSw: | -3.7079 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.564 |
| InChI Key: | LDZWDYQBTKQCDQ-UHFFFAOYSA-N |