(4-{[1-(3-chloro-4-methylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}-2-methoxyphenoxy)acetic acid
Chemical Structure Depiction of
(4-{[1-(3-chloro-4-methylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}-2-methoxyphenoxy)acetic acid
(4-{[1-(3-chloro-4-methylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}-2-methoxyphenoxy)acetic acid
Compound characteristics
| Compound ID: | 8008-6515 |
| Compound Name: | (4-{[1-(3-chloro-4-methylphenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl}-2-methoxyphenoxy)acetic acid |
| Molecular Weight: | 416.82 |
| Molecular Formula: | C20 H17 Cl N2 O6 |
| Smiles: | Cc1ccc(cc1[Cl])N1C(C(=C/c2ccc(c(c2)OC)OCC(O)=O)\C(N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7662 |
| logD: | -1.4707 |
| logSw: | -3.2275 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.36 |
| InChI Key: | CKRDHLGUEYHUNO-UHFFFAOYSA-N |