di(propan-2-yl) 5-[(2H-1,3-benzodioxole-5-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate
Chemical Structure Depiction of
di(propan-2-yl) 5-[(2H-1,3-benzodioxole-5-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate
di(propan-2-yl) 5-[(2H-1,3-benzodioxole-5-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | Y503-0446 |
| Compound Name: | di(propan-2-yl) 5-[(2H-1,3-benzodioxole-5-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate |
| Molecular Weight: | 433.48 |
| Molecular Formula: | C21 H23 N O7 S |
| Smiles: | CC(C)OC(c1c(C)c(C(=O)OC(C)C)sc1NC(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3814 |
| logD: | 1.8357 |
| logSw: | -4.4793 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.105 |
| InChI Key: | RNKVESAJNVRTSU-UHFFFAOYSA-N |