N-(4-chlorophenyl)-N'-{4-[(2,5-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
Chemical Structure Depiction of
N-(4-chlorophenyl)-N'-{4-[(2,5-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
N-(4-chlorophenyl)-N'-{4-[(2,5-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea
Compound characteristics
| Compound ID: | L282-0605 |
| Compound Name: | N-(4-chlorophenyl)-N'-{4-[(2,5-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}urea |
| Molecular Weight: | 424.91 |
| Molecular Formula: | C20 H17 Cl N6 O S |
| Smiles: | Cc1cc(n2c(n1)nc(C)n2)Sc1ccc(cc1)NC(Nc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8368 |
| logD: | 4.8367 |
| logSw: | -4.9532 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.724 |
| InChI Key: | NXXUFHHSOJGSCT-UHFFFAOYSA-N |