5-chloro-N-(6-fluoro-1,3-benzothiazol-2-yl)-2-[(propan-2-yl)sulfanyl]pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-(6-fluoro-1,3-benzothiazol-2-yl)-2-[(propan-2-yl)sulfanyl]pyrimidine-4-carboxamide
5-chloro-N-(6-fluoro-1,3-benzothiazol-2-yl)-2-[(propan-2-yl)sulfanyl]pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D233-0812 |
| Compound Name: | 5-chloro-N-(6-fluoro-1,3-benzothiazol-2-yl)-2-[(propan-2-yl)sulfanyl]pyrimidine-4-carboxamide |
| Molecular Weight: | 382.86 |
| Molecular Formula: | C15 H12 Cl F N4 O S2 |
| Smiles: | CC(C)Sc1ncc(c(C(Nc2nc3ccc(cc3s2)F)=O)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.0609 |
| logD: | 5.0348 |
| logSw: | -5.3523 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.676 |
| InChI Key: | ZDFIOTCNDAXDPX-UHFFFAOYSA-N |