4-[1-(hex-5-ynoyl)piperidin-4-yl]-2-methyl-N-[(pyridin-3-yl)methyl]pyrimidine-5-carboxamide
Chemical Structure Depiction of
4-[1-(hex-5-ynoyl)piperidin-4-yl]-2-methyl-N-[(pyridin-3-yl)methyl]pyrimidine-5-carboxamide
4-[1-(hex-5-ynoyl)piperidin-4-yl]-2-methyl-N-[(pyridin-3-yl)methyl]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | T003-0466 |
| Compound Name: | 4-[1-(hex-5-ynoyl)piperidin-4-yl]-2-methyl-N-[(pyridin-3-yl)methyl]pyrimidine-5-carboxamide |
| Molecular Weight: | 405.5 |
| Molecular Formula: | C23 H27 N5 O2 |
| Smiles: | Cc1ncc(C(NCc2cccnc2)=O)c(C2CCN(CC2)C(CCCC#C)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.5385 |
| logD: | 1.5383 |
| logSw: | -1.5675 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.767 |
| InChI Key: | TUFMSZUROUNQOR-UHFFFAOYSA-N |