N-(3,4-dimethoxyphenyl)-1-[4-(pyrrolidin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-1-[4-(pyrrolidin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide
N-(3,4-dimethoxyphenyl)-1-[4-(pyrrolidin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | P257-0318 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-1-[4-(pyrrolidin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide |
| Molecular Weight: | 411.5 |
| Molecular Formula: | C22 H29 N5 O3 |
| Smiles: | COc1ccc(cc1OC)NC(C1CCN(CC1)c1cncnc1N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2925 |
| logD: | 2.228 |
| logSw: | -2.7281 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.773 |
| InChI Key: | PMCCZVHIFTYZIQ-UHFFFAOYSA-N |