5-chloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-{[(2-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-{[(2-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxamide
5-chloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-{[(2-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D244-0070 |
| Compound Name: | 5-chloro-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-{[(2-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxamide |
| Molecular Weight: | 405.93 |
| Molecular Formula: | C17 H16 Cl N5 O S2 |
| Smiles: | [H]N(C(c1c(cnc(n1)SCc1ccccc1C)[Cl])=O)c1nnc(CC)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.3128 |
| logD: | 3.4432 |
| logSw: | -5.773 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.684 |
| InChI Key: | JOIOMWIRMZOMSI-UHFFFAOYSA-N |