methyl 5-(dimethylcarbamoyl)-4-methyl-2-[(2-oxo-2H-1-benzopyran-3-carbonyl)amino]thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 5-(dimethylcarbamoyl)-4-methyl-2-[(2-oxo-2H-1-benzopyran-3-carbonyl)amino]thiophene-3-carboxylate
methyl 5-(dimethylcarbamoyl)-4-methyl-2-[(2-oxo-2H-1-benzopyran-3-carbonyl)amino]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y200-6337 |
| Compound Name: | methyl 5-(dimethylcarbamoyl)-4-methyl-2-[(2-oxo-2H-1-benzopyran-3-carbonyl)amino]thiophene-3-carboxylate |
| Molecular Weight: | 414.44 |
| Molecular Formula: | C20 H18 N2 O6 S |
| Smiles: | Cc1c(C(=O)OC)c(NC(C2=Cc3ccccc3OC2=O)=O)sc1C(N(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7046 |
| logD: | -2.6459 |
| logSw: | -2.3502 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.22 |
| InChI Key: | MHVSYJVVEABRAX-UHFFFAOYSA-N |