3-(2-bromophenoxy)-4-oxo-4H-1-benzopyran-7-yl thiophene-2-carboxylate
Chemical Structure Depiction of
3-(2-bromophenoxy)-4-oxo-4H-1-benzopyran-7-yl thiophene-2-carboxylate
3-(2-bromophenoxy)-4-oxo-4H-1-benzopyran-7-yl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | 4300-0867 |
| Compound Name: | 3-(2-bromophenoxy)-4-oxo-4H-1-benzopyran-7-yl thiophene-2-carboxylate |
| Molecular Weight: | 443.27 |
| Molecular Formula: | C20 H11 Br O5 S |
| Smiles: | C1=C(C(c2ccc(cc2O1)OC(c1cccs1)=O)=O)Oc1ccccc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.8251 |
| logD: | 4.8251 |
| logSw: | -4.9822 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.053 |
| InChI Key: | JNUOUEJACHRZPU-UHFFFAOYSA-N |