ethyl 2-({3-[(4-fluorophenyl)carbamoyl]-6-methoxy-2H-1-benzopyran-2-ylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-({3-[(4-fluorophenyl)carbamoyl]-6-methoxy-2H-1-benzopyran-2-ylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-({3-[(4-fluorophenyl)carbamoyl]-6-methoxy-2H-1-benzopyran-2-ylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 2432-4448 |
| Compound Name: | ethyl 2-({3-[(4-fluorophenyl)carbamoyl]-6-methoxy-2H-1-benzopyran-2-ylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 520.58 |
| Molecular Formula: | C28 H25 F N2 O5 S |
| Smiles: | CCOC(c1c2CCCCc2sc1/N=C1/C(=Cc2cc(ccc2O1)OC)C(Nc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8529 |
| logD: | 5.8474 |
| logSw: | -5.5495 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.049 |
| InChI Key: | YKGSXCWUNLAMCC-UHFFFAOYSA-N |