5-(5-{[1-(3,4-dichlorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}furan-2-yl)-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
5-(5-{[1-(3,4-dichlorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}furan-2-yl)-1H-isoindole-1,3(2H)-dione
5-(5-{[1-(3,4-dichlorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}furan-2-yl)-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 4357-0842 |
| Compound Name: | 5-(5-{[1-(3,4-dichlorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}furan-2-yl)-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 468.25 |
| Molecular Formula: | C22 H11 Cl2 N3 O5 |
| Smiles: | C(=C1/C(NN(C1=O)c1ccc(c(c1)[Cl])[Cl])=O)/c1ccc(c2ccc3C(NC(c3c2)=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.8203 |
| logD: | 2.7132 |
| logSw: | -4.4611 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.095 |
| InChI Key: | QPORCHKCDQHFKS-UHFFFAOYSA-N |