5-chloro-N-(6-chloro-1,3-benzothiazol-2-yl)-2-(ethylsulfanyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-(6-chloro-1,3-benzothiazol-2-yl)-2-(ethylsulfanyl)pyrimidine-4-carboxamide
5-chloro-N-(6-chloro-1,3-benzothiazol-2-yl)-2-(ethylsulfanyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0364 |
| Compound Name: | 5-chloro-N-(6-chloro-1,3-benzothiazol-2-yl)-2-(ethylsulfanyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 385.29 |
| Molecular Formula: | C14 H10 Cl2 N4 O S2 |
| Smiles: | CCSc1ncc(c(C(Nc2nc3ccc(cc3s2)[Cl])=O)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.2287 |
| logD: | 5.0415 |
| logSw: | -5.6979 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.676 |
| InChI Key: | MQNBXQQKBFEECF-UHFFFAOYSA-N |