N-(4-bromo-2-methylphenyl)-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2-methylphenyl)-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide
N-(4-bromo-2-methylphenyl)-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide
Compound characteristics
| Compound ID: | E146-0245 |
| Compound Name: | N-(4-bromo-2-methylphenyl)-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide |
| Molecular Weight: | 385.21 |
| Molecular Formula: | C18 H13 Br N2 O3 |
| Smiles: | Cc1cc(ccc1NC(c1c2COc3ccccc3c2on1)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.3842 |
| logD: | 4.3821 |
| logSw: | -4.4423 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.162 |
| InChI Key: | WSTVXBSTOQITKZ-UHFFFAOYSA-N |