N-benzyl-5-chloro-2-(ethanesulfonyl)-N-(pyridin-2-yl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
N-benzyl-5-chloro-2-(ethanesulfonyl)-N-(pyridin-2-yl)pyrimidine-4-carboxamide
N-benzyl-5-chloro-2-(ethanesulfonyl)-N-(pyridin-2-yl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D075-0145 |
| Compound Name: | N-benzyl-5-chloro-2-(ethanesulfonyl)-N-(pyridin-2-yl)pyrimidine-4-carboxamide |
| Molecular Weight: | 416.88 |
| Molecular Formula: | C19 H17 Cl N4 O3 S |
| Smiles: | CCS(c1ncc(c(C(N(Cc2ccccc2)c2ccccn2)=O)n1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.34 |
| logD: | 3.3399 |
| logSw: | -3.3948 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.55 |
| InChI Key: | XJVNBQROPREUQW-UHFFFAOYSA-N |