ethyl 2-chloro-5-(5-{[1-(4-methylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}furan-2-yl)benzoate
Chemical Structure Depiction of
ethyl 2-chloro-5-(5-{[1-(4-methylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}furan-2-yl)benzoate
ethyl 2-chloro-5-(5-{[1-(4-methylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}furan-2-yl)benzoate
Compound characteristics
Compound ID: | 2082-0168 |
Compound Name: | ethyl 2-chloro-5-(5-{[1-(4-methylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}furan-2-yl)benzoate |
Molecular Weight: | 450.88 |
Molecular Formula: | C24 H19 Cl N2 O5 |
Smiles: | CCOC(c1cc(ccc1[Cl])c1ccc(/C=C2/C(NN(C2=O)c2ccc(C)cc2)=O)o1)=O |
Stereo: | ACHIRAL |
logP: | 5.1749 |
logD: | 5.0901 |
logSw: | -5.494 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.083 |
InChI Key: | UXLGAWWLUWLREP-UHFFFAOYSA-N |