N-{2-[(5,6-dimethyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-N'-(4-fluorophenyl)urea
Chemical Structure Depiction of
N-{2-[(5,6-dimethyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-N'-(4-fluorophenyl)urea
N-{2-[(5,6-dimethyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-N'-(4-fluorophenyl)urea
Compound characteristics
| Compound ID: | F781-0409 |
| Compound Name: | N-{2-[(5,6-dimethyl-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)sulfanyl]phenyl}-N'-(4-fluorophenyl)urea |
| Molecular Weight: | 484.55 |
| Molecular Formula: | C26 H21 F N6 O S |
| Smiles: | Cc1c(C)nc2nc(c3ccccc3)nn2c1Sc1ccccc1NC(Nc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 6.136 |
| logD: | 6.1358 |
| logSw: | -5.6724 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.688 |
| InChI Key: | BPDLWGKKPJAOJR-UHFFFAOYSA-N |