3-(2-methoxy-2-oxoethyl)-4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl thiophene-2-carboxylate
Chemical Structure Depiction of
3-(2-methoxy-2-oxoethyl)-4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl thiophene-2-carboxylate
3-(2-methoxy-2-oxoethyl)-4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | D715-1018 |
| Compound Name: | 3-(2-methoxy-2-oxoethyl)-4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl thiophene-2-carboxylate |
| Molecular Weight: | 372.39 |
| Molecular Formula: | C19 H16 O6 S |
| Smiles: | CC1=C(CC(=O)OC)C(=O)Oc2cc(C)cc(c12)OC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8545 |
| logD: | 3.8545 |
| logSw: | -4.2203 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.222 |
| InChI Key: | IWRAWCCFGKWZJA-UHFFFAOYSA-N |