5-chloro-N-(2,5-dimethylphenyl)-2-(phenylmethanesulfonyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-(2,5-dimethylphenyl)-2-(phenylmethanesulfonyl)pyrimidine-4-carboxamide
5-chloro-N-(2,5-dimethylphenyl)-2-(phenylmethanesulfonyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D233-0488 |
| Compound Name: | 5-chloro-N-(2,5-dimethylphenyl)-2-(phenylmethanesulfonyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 415.9 |
| Molecular Formula: | C20 H18 Cl N3 O3 S |
| Smiles: | [H]N(C(c1c(cnc(n1)S(Cc1ccccc1)(=O)=O)[Cl])=O)c1cc(C)ccc1C |
| Stereo: | ACHIRAL |
| logP: | 3.593 |
| logD: | 3.5773 |
| logSw: | -3.7479 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.81 |
| InChI Key: | JQBDCXSBHJLJTD-UHFFFAOYSA-N |