5-chloro-N-(2,6-dimethylphenyl)-2-[(2-methylphenyl)methanesulfonyl]pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-(2,6-dimethylphenyl)-2-[(2-methylphenyl)methanesulfonyl]pyrimidine-4-carboxamide
5-chloro-N-(2,6-dimethylphenyl)-2-[(2-methylphenyl)methanesulfonyl]pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D244-0227 |
| Compound Name: | 5-chloro-N-(2,6-dimethylphenyl)-2-[(2-methylphenyl)methanesulfonyl]pyrimidine-4-carboxamide |
| Molecular Weight: | 429.92 |
| Molecular Formula: | C21 H20 Cl N3 O3 S |
| Smiles: | [H]N(C(c1c(cnc(n1)S(Cc1ccccc1C)(=O)=O)[Cl])=O)c1c(C)cccc1C |
| Stereo: | ACHIRAL |
| logP: | 4.4565 |
| logD: | 4.4164 |
| logSw: | -4.3607 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.112 |
| InChI Key: | BVAGSVNJNBMBOV-UHFFFAOYSA-N |