N-[(2,3-dimethoxyphenyl)methyl]-1-[4-(pyrrolidin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(2,3-dimethoxyphenyl)methyl]-1-[4-(pyrrolidin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide
N-[(2,3-dimethoxyphenyl)methyl]-1-[4-(pyrrolidin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | P257-0253 |
| Compound Name: | N-[(2,3-dimethoxyphenyl)methyl]-1-[4-(pyrrolidin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide |
| Molecular Weight: | 425.53 |
| Molecular Formula: | C23 H31 N5 O3 |
| Smiles: | COc1cccc(CNC(C2CCN(CC2)c2cncnc2N2CCCC2)=O)c1OC |
| Stereo: | ACHIRAL |
| logP: | 2.5873 |
| logD: | 2.5146 |
| logSw: | -2.6805 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.182 |
| InChI Key: | RAGFMGUFHKCRJL-UHFFFAOYSA-N |