5-chloro-N-(6-fluoro-1,3-benzothiazol-2-yl)-2-[(4-fluorophenyl)methanesulfonyl]pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-(6-fluoro-1,3-benzothiazol-2-yl)-2-[(4-fluorophenyl)methanesulfonyl]pyrimidine-4-carboxamide
5-chloro-N-(6-fluoro-1,3-benzothiazol-2-yl)-2-[(4-fluorophenyl)methanesulfonyl]pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D233-0830 |
| Compound Name: | 5-chloro-N-(6-fluoro-1,3-benzothiazol-2-yl)-2-[(4-fluorophenyl)methanesulfonyl]pyrimidine-4-carboxamide |
| Molecular Weight: | 480.9 |
| Molecular Formula: | C19 H11 Cl F2 N4 O3 S2 |
| Smiles: | C(c1ccc(cc1)F)S(c1ncc(c(C(Nc2nc3ccc(cc3s2)F)=O)n1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3017 |
| logD: | 4.0484 |
| logSw: | -4.418 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.269 |
| InChI Key: | QYNSJMFASBJCEG-UHFFFAOYSA-N |