5-chloro-2-{[(4-fluorophenyl)methyl]sulfanyl}-N-(5-propyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-2-{[(4-fluorophenyl)methyl]sulfanyl}-N-(5-propyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide
5-chloro-2-{[(4-fluorophenyl)methyl]sulfanyl}-N-(5-propyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D233-0545 |
| Compound Name: | 5-chloro-2-{[(4-fluorophenyl)methyl]sulfanyl}-N-(5-propyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide |
| Molecular Weight: | 423.92 |
| Molecular Formula: | C17 H15 Cl F N5 O S2 |
| Smiles: | [H]N(C(c1c(cnc(n1)SCc1ccc(cc1)F)[Cl])=O)c1nnc(CCC)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.8041 |
| logD: | 2.9346 |
| logSw: | -4.807 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.684 |
| InChI Key: | JGBMRMZKIXBKMR-UHFFFAOYSA-N |