2-methyl-4-[1-(pent-4-ynoyl)piperidin-4-yl]-N-[2-(pyridin-3-yl)ethyl]pyrimidine-5-carboxamide
Chemical Structure Depiction of
2-methyl-4-[1-(pent-4-ynoyl)piperidin-4-yl]-N-[2-(pyridin-3-yl)ethyl]pyrimidine-5-carboxamide
2-methyl-4-[1-(pent-4-ynoyl)piperidin-4-yl]-N-[2-(pyridin-3-yl)ethyl]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | T003-0133 |
| Compound Name: | 2-methyl-4-[1-(pent-4-ynoyl)piperidin-4-yl]-N-[2-(pyridin-3-yl)ethyl]pyrimidine-5-carboxamide |
| Molecular Weight: | 405.5 |
| Molecular Formula: | C23 H27 N5 O2 |
| Smiles: | Cc1ncc(C(NCCc2cccnc2)=O)c(C2CCN(CC2)C(CCC#C)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.8862 |
| logD: | 0.8846 |
| logSw: | -1.3578 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.608 |
| InChI Key: | ZRPCCRQCRMZHFD-UHFFFAOYSA-N |