4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl thiophene-2-carboxylate
Chemical Structure Depiction of
4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl thiophene-2-carboxylate
4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | 2712-4058 |
| Compound Name: | 4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl thiophene-2-carboxylate |
| Molecular Weight: | 312.34 |
| Molecular Formula: | C17 H12 O4 S |
| Smiles: | C1CC2=C(C1)c1ccc(cc1OC2=O)OC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4069 |
| logD: | 3.4069 |
| logSw: | -3.756 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.843 |
| InChI Key: | NSCMIWYTXQDBTP-UHFFFAOYSA-N |