N-(5-chloro-2-{[7-oxo-1-(propan-2-yl)-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]methoxy}phenyl)-N'-(2-methoxy-5-methylphenyl)urea
Chemical Structure Depiction of
N-(5-chloro-2-{[7-oxo-1-(propan-2-yl)-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]methoxy}phenyl)-N'-(2-methoxy-5-methylphenyl)urea
N-(5-chloro-2-{[7-oxo-1-(propan-2-yl)-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]methoxy}phenyl)-N'-(2-methoxy-5-methylphenyl)urea
Compound characteristics
| Compound ID: | D471-1355 |
| Compound Name: | N-(5-chloro-2-{[7-oxo-1-(propan-2-yl)-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]methoxy}phenyl)-N'-(2-methoxy-5-methylphenyl)urea |
| Molecular Weight: | 496.95 |
| Molecular Formula: | C24 H25 Cl N6 O4 |
| Smiles: | CC(C)N1C=NC2=NC(COc3ccc(cc3NC(Nc3cc(C)ccc3OC)=O)[Cl])=CC(N12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1221 |
| logD: | 2.7787 |
| logSw: | -3.4572 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.3 |
| InChI Key: | XXELNHNLJHJTQT-UHFFFAOYSA-N |