N-{2-[(4-chlorophenyl)sulfanyl]phenyl}[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-{2-[(4-chlorophenyl)sulfanyl]phenyl}[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
N-{2-[(4-chlorophenyl)sulfanyl]phenyl}[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | Y502-8542 |
| Compound Name: | N-{2-[(4-chlorophenyl)sulfanyl]phenyl}[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 381.84 |
| Molecular Formula: | C18 H12 Cl N5 O S |
| Smiles: | c1ccc(c(c1)NC(c1nc2ncccn2n1)=O)Sc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.3289 |
| logD: | 3.3289 |
| logSw: | -3.7785 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.978 |
| InChI Key: | MWSPZGJYKPUOII-UHFFFAOYSA-N |