methyl 6-[(4,5-dihydrothieno[2,3-g][1,2]benzoxazole-3-carbonyl)amino]-2H-1,3-benzodioxole-5-carboxylate
Chemical Structure Depiction of
methyl 6-[(4,5-dihydrothieno[2,3-g][1,2]benzoxazole-3-carbonyl)amino]-2H-1,3-benzodioxole-5-carboxylate
methyl 6-[(4,5-dihydrothieno[2,3-g][1,2]benzoxazole-3-carbonyl)amino]-2H-1,3-benzodioxole-5-carboxylate
Compound characteristics
| Compound ID: | G213-0259 |
| Compound Name: | methyl 6-[(4,5-dihydrothieno[2,3-g][1,2]benzoxazole-3-carbonyl)amino]-2H-1,3-benzodioxole-5-carboxylate |
| Molecular Weight: | 398.39 |
| Molecular Formula: | C19 H14 N2 O6 S |
| Smiles: | COC(c1cc2c(cc1NC(c1c3CCc4c(ccs4)c3on1)=O)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7567 |
| logD: | 3.0913 |
| logSw: | -4.0768 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.02 |
| InChI Key: | HCBBPJMZVBCTTQ-UHFFFAOYSA-N |