N-(4H-[1]benzopyrano[3,4-d][1,2]oxazol-3-yl)-N'-(2-bromo-4-methylphenyl)urea
Chemical Structure Depiction of
N-(4H-[1]benzopyrano[3,4-d][1,2]oxazol-3-yl)-N'-(2-bromo-4-methylphenyl)urea
N-(4H-[1]benzopyrano[3,4-d][1,2]oxazol-3-yl)-N'-(2-bromo-4-methylphenyl)urea
Compound characteristics
| Compound ID: | E466-0009 |
| Compound Name: | N-(4H-[1]benzopyrano[3,4-d][1,2]oxazol-3-yl)-N'-(2-bromo-4-methylphenyl)urea |
| Molecular Weight: | 400.23 |
| Molecular Formula: | C18 H14 Br N3 O3 |
| Smiles: | Cc1ccc(c(c1)[Br])NC(Nc1c2COc3ccccc3c2on1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5901 |
| logD: | 4.5901 |
| logSw: | -4.4817 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.243 |
| InChI Key: | DZPKYBWVILDTIZ-UHFFFAOYSA-N |