N-(4-ethylphenyl)-N'-(2-{[7-oxo-1-(propan-2-yl)-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]methoxy}phenyl)urea
Chemical Structure Depiction of
N-(4-ethylphenyl)-N'-(2-{[7-oxo-1-(propan-2-yl)-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]methoxy}phenyl)urea
N-(4-ethylphenyl)-N'-(2-{[7-oxo-1-(propan-2-yl)-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]methoxy}phenyl)urea
Compound characteristics
| Compound ID: | D471-0009 |
| Compound Name: | N-(4-ethylphenyl)-N'-(2-{[7-oxo-1-(propan-2-yl)-1,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]methoxy}phenyl)urea |
| Molecular Weight: | 446.51 |
| Molecular Formula: | C24 H26 N6 O3 |
| Smiles: | CCc1ccc(cc1)NC(Nc1ccccc1OCC1=CC(N2C(N=CN2C(C)C)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7152 |
| logD: | 3.3717 |
| logSw: | -4.1028 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.368 |
| InChI Key: | GDRNAXLQKXFSCD-UHFFFAOYSA-N |