4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl thiophene-2-carboxylate
Chemical Structure Depiction of
4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl thiophene-2-carboxylate
4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | Y040-3799 |
| Compound Name: | 4,8-dimethyl-2-oxo-2H-1-benzopyran-7-yl thiophene-2-carboxylate |
| Molecular Weight: | 300.33 |
| Molecular Formula: | C16 H12 O4 S |
| Smiles: | CC1=CC(=O)Oc2c1ccc(c2C)OC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6192 |
| logD: | 3.6192 |
| logSw: | -3.8293 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.813 |
| InChI Key: | AETVJZKADVWYCU-UHFFFAOYSA-N |