methyl 2-chloro-5-{5-[(5-cyano-6-hydroxy-4-methyl-2-oxopyridin-3(2H)-ylidene)methyl]furan-2-yl}benzoate
Chemical Structure Depiction of
methyl 2-chloro-5-{5-[(5-cyano-6-hydroxy-4-methyl-2-oxopyridin-3(2H)-ylidene)methyl]furan-2-yl}benzoate
methyl 2-chloro-5-{5-[(5-cyano-6-hydroxy-4-methyl-2-oxopyridin-3(2H)-ylidene)methyl]furan-2-yl}benzoate
Compound characteristics
| Compound ID: | 4338-0729 |
| Compound Name: | methyl 2-chloro-5-{5-[(5-cyano-6-hydroxy-4-methyl-2-oxopyridin-3(2H)-ylidene)methyl]furan-2-yl}benzoate |
| Molecular Weight: | 396.79 |
| Molecular Formula: | C20 H13 Cl N2 O5 |
| Smiles: | CC1/C(=C/c2ccc(c3ccc(c(c3)C(=O)OC)[Cl])o2)C(N=C(C=1C#N)O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3289 |
| logD: | -2.715 |
| logSw: | -3.6698 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.847 |
| InChI Key: | MZPCPPAFHQKUBV-UHFFFAOYSA-N |