2-methyl-4-[1-(2-methylprop-2-enoyl)piperidin-4-yl]-N-[(pyridin-3-yl)methyl]pyrimidine-5-carboxamide
Chemical Structure Depiction of
2-methyl-4-[1-(2-methylprop-2-enoyl)piperidin-4-yl]-N-[(pyridin-3-yl)methyl]pyrimidine-5-carboxamide
2-methyl-4-[1-(2-methylprop-2-enoyl)piperidin-4-yl]-N-[(pyridin-3-yl)methyl]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | T003-0098 |
| Compound Name: | 2-methyl-4-[1-(2-methylprop-2-enoyl)piperidin-4-yl]-N-[(pyridin-3-yl)methyl]pyrimidine-5-carboxamide |
| Molecular Weight: | 379.46 |
| Molecular Formula: | C21 H25 N5 O2 |
| Smiles: | CC(=C)C(N1CCC(CC1)c1c(cnc(C)n1)C(NCc1cccnc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7664 |
| logD: | 1.7663 |
| logSw: | -1.7425 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.294 |
| InChI Key: | FSEDBEISZHAIJA-UHFFFAOYSA-N |