di(propan-2-yl) 3-methyl-5-[(1-oxo-1H-2-benzopyran-3-carbonyl)amino]thiophene-2,4-dicarboxylate
Chemical Structure Depiction of
di(propan-2-yl) 3-methyl-5-[(1-oxo-1H-2-benzopyran-3-carbonyl)amino]thiophene-2,4-dicarboxylate
di(propan-2-yl) 3-methyl-5-[(1-oxo-1H-2-benzopyran-3-carbonyl)amino]thiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | 6049-1405 |
| Compound Name: | di(propan-2-yl) 3-methyl-5-[(1-oxo-1H-2-benzopyran-3-carbonyl)amino]thiophene-2,4-dicarboxylate |
| Molecular Weight: | 457.5 |
| Molecular Formula: | C23 H23 N O7 S |
| Smiles: | CC(C)OC(c1c(C)c(C(=O)OC(C)C)sc1NC(C1=Cc2ccccc2C(=O)O1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4603 |
| logD: | 0.6722 |
| logSw: | -4.5413 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.396 |
| InChI Key: | IPZZNYNMIPWCLJ-UHFFFAOYSA-N |