2-methylpropyl 2-chloro-5-{5-[(5-cyano-1,4-dimethyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene)methyl]furan-2-yl}benzoate
Chemical Structure Depiction of
2-methylpropyl 2-chloro-5-{5-[(5-cyano-1,4-dimethyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene)methyl]furan-2-yl}benzoate
2-methylpropyl 2-chloro-5-{5-[(5-cyano-1,4-dimethyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene)methyl]furan-2-yl}benzoate
Compound characteristics
| Compound ID: | 5820-3174 |
| Compound Name: | 2-methylpropyl 2-chloro-5-{5-[(5-cyano-1,4-dimethyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene)methyl]furan-2-yl}benzoate |
| Molecular Weight: | 452.89 |
| Molecular Formula: | C24 H21 Cl N2 O5 |
| Smiles: | CC(C)COC(c1cc(ccc1[Cl])c1ccc(/C=C2/C(C)=C(C#N)C(N(C)C2=O)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8327 |
| logD: | 4.8327 |
| logSw: | -4.8859 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.918 |
| InChI Key: | NQXHBYCCJTYBNQ-UHFFFAOYSA-N |