ethyl 4-(5-bromo-2-fluorophenyl)-5-cyano-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate
Chemical Structure Depiction of
ethyl 4-(5-bromo-2-fluorophenyl)-5-cyano-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate
ethyl 4-(5-bromo-2-fluorophenyl)-5-cyano-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate
Compound characteristics
| Compound ID: | 8017-7950 |
| Compound Name: | ethyl 4-(5-bromo-2-fluorophenyl)-5-cyano-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate |
| Molecular Weight: | 431.26 |
| Molecular Formula: | C20 H16 Br F N2 O3 |
| Smiles: | CCOC(C1C(C(C#N)=C(n2cccc2)OC=1C)c1cc(ccc1F)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9276 |
| logD: | 4.9276 |
| logSw: | -4.6616 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.229 |
| InChI Key: | VPCQSTZRKTVYPH-GOSISDBHSA-N |