methyl 6-[(4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carbonyl)amino]-2H-1,3-benzodioxole-5-carboxylate
Chemical Structure Depiction of
methyl 6-[(4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carbonyl)amino]-2H-1,3-benzodioxole-5-carboxylate
methyl 6-[(4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carbonyl)amino]-2H-1,3-benzodioxole-5-carboxylate
Compound characteristics
| Compound ID: | E146-0472 |
| Compound Name: | methyl 6-[(4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carbonyl)amino]-2H-1,3-benzodioxole-5-carboxylate |
| Molecular Weight: | 394.34 |
| Molecular Formula: | C20 H14 N2 O7 |
| Smiles: | COC(c1cc2c(cc1NC(c1c3COc4ccccc4c3on1)=O)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2785 |
| logD: | 2.3561 |
| logSw: | -3.7252 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.451 |
| InChI Key: | YNQUKDOTSMDGTI-UHFFFAOYSA-N |