5-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(phenylmethanesulfonyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(phenylmethanesulfonyl)pyrimidine-4-carboxamide
5-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(phenylmethanesulfonyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D233-0886 |
| Compound Name: | 5-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(phenylmethanesulfonyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 474.94 |
| Molecular Formula: | C20 H15 Cl N4 O4 S2 |
| Smiles: | COc1ccc2c(c1)sc(NC(c1c(cnc(n1)S(Cc1ccccc1)(=O)=O)[Cl])=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.2796 |
| logD: | 4.1355 |
| logSw: | -4.4664 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.813 |
| InChI Key: | FHLWMONSLWJZIF-UHFFFAOYSA-N |