2-methyl-N-(2-phenylethyl)-4-[1-(prop-2-enoyl)piperidin-4-yl]pyrimidine-5-carboxamide
Chemical Structure Depiction of
2-methyl-N-(2-phenylethyl)-4-[1-(prop-2-enoyl)piperidin-4-yl]pyrimidine-5-carboxamide
2-methyl-N-(2-phenylethyl)-4-[1-(prop-2-enoyl)piperidin-4-yl]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | T003-0105 |
| Compound Name: | 2-methyl-N-(2-phenylethyl)-4-[1-(prop-2-enoyl)piperidin-4-yl]pyrimidine-5-carboxamide |
| Molecular Weight: | 378.47 |
| Molecular Formula: | C22 H26 N4 O2 |
| Smiles: | Cc1ncc(C(NCCc2ccccc2)=O)c(C2CCN(CC2)C(C=C)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.343 |
| logD: | 2.3429 |
| logSw: | -2.8861 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.09 |
| InChI Key: | DUOCHZPGRLZMAR-UHFFFAOYSA-N |