3-(3-methylphenoxy)-4-oxo-4H-1-benzopyran-7-yl thiophene-2-carboxylate
Chemical Structure Depiction of
3-(3-methylphenoxy)-4-oxo-4H-1-benzopyran-7-yl thiophene-2-carboxylate
3-(3-methylphenoxy)-4-oxo-4H-1-benzopyran-7-yl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | 4790-1372 |
| Compound Name: | 3-(3-methylphenoxy)-4-oxo-4H-1-benzopyran-7-yl thiophene-2-carboxylate |
| Molecular Weight: | 378.4 |
| Molecular Formula: | C21 H14 O5 S |
| Smiles: | Cc1cccc(c1)OC1=COc2cc(ccc2C1=O)OC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5756 |
| logD: | 4.5756 |
| logSw: | -4.6224 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.966 |
| InChI Key: | KKUDDOGQFHDNQS-UHFFFAOYSA-N |