5-chloro-2-[(2-fluorophenyl)methanesulfonyl]-N-(6-methyl-1,3-benzothiazol-2-yl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-2-[(2-fluorophenyl)methanesulfonyl]-N-(6-methyl-1,3-benzothiazol-2-yl)pyrimidine-4-carboxamide
5-chloro-2-[(2-fluorophenyl)methanesulfonyl]-N-(6-methyl-1,3-benzothiazol-2-yl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D233-0862 |
| Compound Name: | 5-chloro-2-[(2-fluorophenyl)methanesulfonyl]-N-(6-methyl-1,3-benzothiazol-2-yl)pyrimidine-4-carboxamide |
| Molecular Weight: | 476.93 |
| Molecular Formula: | C20 H14 Cl F N4 O3 S2 |
| Smiles: | Cc1ccc2c(c1)sc(NC(c1c(cnc(n1)S(Cc1ccccc1F)(=O)=O)[Cl])=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.1536 |
| logD: | 4.9657 |
| logSw: | -5.5948 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.269 |
| InChI Key: | BPTBFGVHGYFYMG-UHFFFAOYSA-N |