methyl 2-[(2H-1,3-benzodioxole-5-carbonyl)amino]-4-(3,4-dimethylphenyl)-5-methylthiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-[(2H-1,3-benzodioxole-5-carbonyl)amino]-4-(3,4-dimethylphenyl)-5-methylthiophene-3-carboxylate
methyl 2-[(2H-1,3-benzodioxole-5-carbonyl)amino]-4-(3,4-dimethylphenyl)-5-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y200-6360 |
| Compound Name: | methyl 2-[(2H-1,3-benzodioxole-5-carbonyl)amino]-4-(3,4-dimethylphenyl)-5-methylthiophene-3-carboxylate |
| Molecular Weight: | 423.49 |
| Molecular Formula: | C23 H21 N O5 S |
| Smiles: | Cc1ccc(cc1C)c1c(C(=O)OC)c(NC(c2ccc3c(c2)OCO3)=O)sc1C |
| Stereo: | ACHIRAL |
| logP: | 5.3559 |
| logD: | 4.955 |
| logSw: | -5.5106 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.142 |
| InChI Key: | PQUZDRXQCVAMJV-UHFFFAOYSA-N |