7-methyl-2-oxo-4-propyl-2H-1-benzopyran-5-yl thiophene-2-carboxylate
Chemical Structure Depiction of
7-methyl-2-oxo-4-propyl-2H-1-benzopyran-5-yl thiophene-2-carboxylate
7-methyl-2-oxo-4-propyl-2H-1-benzopyran-5-yl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | Y040-1312 |
| Compound Name: | 7-methyl-2-oxo-4-propyl-2H-1-benzopyran-5-yl thiophene-2-carboxylate |
| Molecular Weight: | 328.38 |
| Molecular Formula: | C18 H16 O4 S |
| Smiles: | CCCC1=CC(=O)Oc2cc(C)cc(c12)OC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7072 |
| logD: | 4.7072 |
| logSw: | -4.6298 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.129 |
| InChI Key: | CJPIEAUXYWNZFC-UHFFFAOYSA-N |