methyl 5-cyano-4-(4-hydroxyphenyl)-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate
Chemical Structure Depiction of
methyl 5-cyano-4-(4-hydroxyphenyl)-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate
methyl 5-cyano-4-(4-hydroxyphenyl)-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate
Compound characteristics
| Compound ID: | 8017-8703 |
| Compound Name: | methyl 5-cyano-4-(4-hydroxyphenyl)-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate |
| Molecular Weight: | 336.35 |
| Molecular Formula: | C19 H16 N2 O4 |
| Smiles: | CC1=C(C(C(C#N)=C(n2cccc2)O1)c1ccc(cc1)O)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6819 |
| logD: | 2.6817 |
| logSw: | -2.7992 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.266 |
| InChI Key: | IHLZXERAPQZXSO-QGZVFWFLSA-N |