5-chloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-{[(2-fluorophenyl)methyl]sulfanyl}pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-{[(2-fluorophenyl)methyl]sulfanyl}pyrimidine-4-carboxamide
5-chloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-{[(2-fluorophenyl)methyl]sulfanyl}pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D233-0699 |
| Compound Name: | 5-chloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-{[(2-fluorophenyl)methyl]sulfanyl}pyrimidine-4-carboxamide |
| Molecular Weight: | 409.89 |
| Molecular Formula: | C16 H13 Cl F N5 O S2 |
| Smiles: | [H]N(C(c1c(cnc(n1)SCc1ccccc1F)[Cl])=O)c1nnc(CC)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.7992 |
| logD: | 2.9297 |
| logSw: | -4.8392 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.684 |
| InChI Key: | RALCBLLGMBTIHZ-UHFFFAOYSA-N |