5-chloro-N-(6-fluoro-1,3-benzothiazol-2-yl)-2-{[(4-fluorophenyl)methyl]sulfanyl}pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-(6-fluoro-1,3-benzothiazol-2-yl)-2-{[(4-fluorophenyl)methyl]sulfanyl}pyrimidine-4-carboxamide
5-chloro-N-(6-fluoro-1,3-benzothiazol-2-yl)-2-{[(4-fluorophenyl)methyl]sulfanyl}pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D233-0562 |
| Compound Name: | 5-chloro-N-(6-fluoro-1,3-benzothiazol-2-yl)-2-{[(4-fluorophenyl)methyl]sulfanyl}pyrimidine-4-carboxamide |
| Molecular Weight: | 448.9 |
| Molecular Formula: | C19 H11 Cl F2 N4 O S2 |
| Smiles: | C(c1ccc(cc1)F)Sc1ncc(c(C(Nc2nc3ccc(cc3s2)F)=O)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.4922 |
| logD: | 5.4661 |
| logSw: | -5.9859 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.405 |
| InChI Key: | VZHCGPNLTKLUBQ-UHFFFAOYSA-N |