3-chloro-N-{4-[(5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}benzamide
Chemical Structure Depiction of
3-chloro-N-{4-[(5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}benzamide
3-chloro-N-{4-[(5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}benzamide
Compound characteristics
| Compound ID: | L281-0202 |
| Compound Name: | 3-chloro-N-{4-[(5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}benzamide |
| Molecular Weight: | 423.92 |
| Molecular Formula: | C21 H18 Cl N5 O S |
| Smiles: | CCCc1cc(n2c(ncn2)n1)Sc1ccc(cc1)NC(c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.362 |
| logD: | 5.3612 |
| logSw: | -5.8411 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.529 |
| InChI Key: | QYYOYALKGRTTLC-UHFFFAOYSA-N |