5-chloro-2-{[(3-methylphenyl)methyl]sulfanyl}-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-2-{[(3-methylphenyl)methyl]sulfanyl}-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide
5-chloro-2-{[(3-methylphenyl)methyl]sulfanyl}-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D244-0164 |
| Compound Name: | 5-chloro-2-{[(3-methylphenyl)methyl]sulfanyl}-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide |
| Molecular Weight: | 391.9 |
| Molecular Formula: | C16 H14 Cl N5 O S2 |
| Smiles: | [H]N(C(c1c(cnc(n1)SCc1cccc(C)c1)[Cl])=O)c1nnc(C)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.395 |
| logD: | 2.5051 |
| logSw: | -4.4101 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.995 |
| InChI Key: | XRVNTVAGNICXTC-UHFFFAOYSA-N |