5-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)-2-(methylsulfanyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)-2-(methylsulfanyl)pyrimidine-4-carboxamide
5-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)-2-(methylsulfanyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0254 |
| Compound Name: | 5-chloro-N-(6-methyl-1,3-benzothiazol-2-yl)-2-(methylsulfanyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 350.85 |
| Molecular Formula: | C14 H11 Cl N4 O S2 |
| Smiles: | Cc1ccc2c(c1)sc(NC(c1c(cnc(n1)SC)[Cl])=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.5974 |
| logD: | 4.5793 |
| logSw: | -4.6559 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.676 |
| InChI Key: | URGSIXPVQHXINS-UHFFFAOYSA-N |