4-{5-[(3-chlorophenyl)methyl]-2-methyl-6-(propan-2-yl)pyrimidin-4-yl}-N-ethylpiperazine-1-carboxamide
Chemical Structure Depiction of
4-{5-[(3-chlorophenyl)methyl]-2-methyl-6-(propan-2-yl)pyrimidin-4-yl}-N-ethylpiperazine-1-carboxamide
4-{5-[(3-chlorophenyl)methyl]-2-methyl-6-(propan-2-yl)pyrimidin-4-yl}-N-ethylpiperazine-1-carboxamide
Compound characteristics
| Compound ID: | V030-9831 |
| Compound Name: | 4-{5-[(3-chlorophenyl)methyl]-2-methyl-6-(propan-2-yl)pyrimidin-4-yl}-N-ethylpiperazine-1-carboxamide |
| Molecular Weight: | 415.97 |
| Molecular Formula: | C22 H30 Cl N5 O |
| Salt: | not_available |
| Smiles: | CCNC(N1CCN(CC1)c1c(Cc2cccc(c2)[Cl])c(C(C)C)nc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1575 |
| logD: | 5.0229 |
| logSw: | -5.4446 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.803 |
| InChI Key: | RKSQSDILTNKTTG-UHFFFAOYSA-N |