methyl 5-cyano-4-(2,4-dimethoxyphenyl)-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate
Chemical Structure Depiction of
methyl 5-cyano-4-(2,4-dimethoxyphenyl)-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate
methyl 5-cyano-4-(2,4-dimethoxyphenyl)-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate
Compound characteristics
| Compound ID: | 8017-7979 |
| Compound Name: | methyl 5-cyano-4-(2,4-dimethoxyphenyl)-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate |
| Molecular Weight: | 380.4 |
| Molecular Formula: | C21 H20 N2 O5 |
| Smiles: | CC1=C(C(C(C#N)=C(n2cccc2)O1)c1ccc(cc1OC)OC)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4631 |
| logD: | 3.4631 |
| logSw: | -3.7775 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.823 |
| InChI Key: | MUMGIGDMDJJJBX-LJQANCHMSA-N |