4-({2-[4-(2-chloro-6-methylpyridine-4-carbonyl)piperazin-1-yl]-1-[3-(pyrrolidin-1-yl)phenyl]ethoxy}methyl)benzonitrile
Chemical Structure Depiction of
4-({2-[4-(2-chloro-6-methylpyridine-4-carbonyl)piperazin-1-yl]-1-[3-(pyrrolidin-1-yl)phenyl]ethoxy}methyl)benzonitrile
4-({2-[4-(2-chloro-6-methylpyridine-4-carbonyl)piperazin-1-yl]-1-[3-(pyrrolidin-1-yl)phenyl]ethoxy}methyl)benzonitrile
Compound characteristics
| Compound ID: | V008-1180 |
| Compound Name: | 4-({2-[4-(2-chloro-6-methylpyridine-4-carbonyl)piperazin-1-yl]-1-[3-(pyrrolidin-1-yl)phenyl]ethoxy}methyl)benzonitrile |
| Molecular Weight: | 544.1 |
| Molecular Formula: | C31 H34 Cl N5 O2 |
| Salt: | not_available |
| Smiles: | Cc1cc(cc(n1)[Cl])C(N1CCN(CC1)CC(c1cccc(c1)N1CCCC1)OCc1ccc(C#N)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.156 |
| logD: | 4.154 |
| logSw: | -4.5228 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.472 |
| InChI Key: | AZUCLOXZXMEOGW-LJAQVGFWSA-N |