2-methyl-4-[1-(pent-4-ynoyl)piperidin-4-yl]-N-(2-phenylethyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
2-methyl-4-[1-(pent-4-ynoyl)piperidin-4-yl]-N-(2-phenylethyl)pyrimidine-5-carboxamide
2-methyl-4-[1-(pent-4-ynoyl)piperidin-4-yl]-N-(2-phenylethyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | T003-0109 |
| Compound Name: | 2-methyl-4-[1-(pent-4-ynoyl)piperidin-4-yl]-N-(2-phenylethyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C24 H28 N4 O2 |
| Smiles: | Cc1ncc(C(NCCc2ccccc2)=O)c(C2CCN(CC2)C(CCC#C)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.3392 |
| logD: | 2.3392 |
| logSw: | -2.8708 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.09 |
| InChI Key: | CDJIBMAYBQGGSB-UHFFFAOYSA-N |