ethyl 2-({6-methoxy-3-[(3-methylphenyl)carbamoyl]-2H-1-benzopyran-2-ylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-({6-methoxy-3-[(3-methylphenyl)carbamoyl]-2H-1-benzopyran-2-ylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-({6-methoxy-3-[(3-methylphenyl)carbamoyl]-2H-1-benzopyran-2-ylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 2265-3100 |
| Compound Name: | ethyl 2-({6-methoxy-3-[(3-methylphenyl)carbamoyl]-2H-1-benzopyran-2-ylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 516.62 |
| Molecular Formula: | C29 H28 N2 O5 S |
| Smiles: | CCOC(c1c2CCCCc2sc1/N=C1/C(=Cc2cc(ccc2O1)OC)C(Nc1cccc(C)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1838 |
| logD: | 6.1837 |
| logSw: | -5.4209 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.049 |
| InChI Key: | LPQJSEBGUGNBBT-UHFFFAOYSA-N |