propyl 2-chloro-5-(5-{[5-cyano-1-(3-hydroxypropyl)-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene]methyl}furan-2-yl)benzoate
Chemical Structure Depiction of
propyl 2-chloro-5-(5-{[5-cyano-1-(3-hydroxypropyl)-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene]methyl}furan-2-yl)benzoate
propyl 2-chloro-5-(5-{[5-cyano-1-(3-hydroxypropyl)-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene]methyl}furan-2-yl)benzoate
Compound characteristics
| Compound ID: | 4285-2755 |
| Compound Name: | propyl 2-chloro-5-(5-{[5-cyano-1-(3-hydroxypropyl)-4-methyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene]methyl}furan-2-yl)benzoate |
| Molecular Weight: | 482.92 |
| Molecular Formula: | C25 H23 Cl N2 O6 |
| Smiles: | CCCOC(c1cc(ccc1[Cl])c1ccc(/C=C2/C(C)=C(C#N)C(N(CCCO)C2=O)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2829 |
| logD: | 4.2829 |
| logSw: | -4.524 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.705 |
| InChI Key: | LSZZQVKLNPOCRS-UHFFFAOYSA-N |