5-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(propane-1-sulfonyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(propane-1-sulfonyl)pyrimidine-4-carboxamide
5-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(propane-1-sulfonyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D053-0468 |
| Compound Name: | 5-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-(propane-1-sulfonyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 426.9 |
| Molecular Formula: | C16 H15 Cl N4 O4 S2 |
| Smiles: | CCCS(c1ncc(c(C(Nc2nc3ccc(cc3s2)OC)=O)n1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7013 |
| logD: | 3.5572 |
| logSw: | -3.9756 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.084 |
| InChI Key: | XBXFDMDVNHPYEJ-UHFFFAOYSA-N |