4-[1-(3-azidopropanoyl)piperidin-4-yl]-2-methyl-N-(2-phenylethyl)pyrimidine-5-carboxamide
Chemical Structure Depiction of
4-[1-(3-azidopropanoyl)piperidin-4-yl]-2-methyl-N-(2-phenylethyl)pyrimidine-5-carboxamide
4-[1-(3-azidopropanoyl)piperidin-4-yl]-2-methyl-N-(2-phenylethyl)pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | T003-0112 |
| Compound Name: | 4-[1-(3-azidopropanoyl)piperidin-4-yl]-2-methyl-N-(2-phenylethyl)pyrimidine-5-carboxamide |
| Molecular Weight: | 421.5 |
| Molecular Formula: | C22 H27 N7 O2 |
| Smiles: | Cc1ncc(C(NCCc2ccccc2)=O)c(C2CCN(CC2)C(CCN=[N+]=[N-])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.4497 |
| logD: | 1.4496 |
| logSw: | -2.0155 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.608 |
| InChI Key: | XFOLFFACOBDSCT-UHFFFAOYSA-N |