methyl 5-[(2H-1,3-benzodioxole-5-carbonyl)amino]-4-carbamoyl-3-methylthiophene-2-carboxylate
Chemical Structure Depiction of
methyl 5-[(2H-1,3-benzodioxole-5-carbonyl)amino]-4-carbamoyl-3-methylthiophene-2-carboxylate
methyl 5-[(2H-1,3-benzodioxole-5-carbonyl)amino]-4-carbamoyl-3-methylthiophene-2-carboxylate
Compound characteristics
| Compound ID: | Y203-9104 |
| Compound Name: | methyl 5-[(2H-1,3-benzodioxole-5-carbonyl)amino]-4-carbamoyl-3-methylthiophene-2-carboxylate |
| Molecular Weight: | 362.36 |
| Molecular Formula: | C16 H14 N2 O6 S |
| Smiles: | Cc1c(C(N)=O)c(NC(c2ccc3c(c2)OCO3)=O)sc1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 0.9651 |
| logD: | 0.3657 |
| logSw: | -2.2696 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.472 |
| InChI Key: | SHYYDGYPKXKHEE-UHFFFAOYSA-N |