3-{[2-methoxy-6-({1-[2-(4-methylanilino)-2-oxoethyl]-2,5-dioxoimidazolidin-4-ylidene}methyl)phenoxy]methyl}benzoic acid
Chemical Structure Depiction of
3-{[2-methoxy-6-({1-[2-(4-methylanilino)-2-oxoethyl]-2,5-dioxoimidazolidin-4-ylidene}methyl)phenoxy]methyl}benzoic acid
3-{[2-methoxy-6-({1-[2-(4-methylanilino)-2-oxoethyl]-2,5-dioxoimidazolidin-4-ylidene}methyl)phenoxy]methyl}benzoic acid
Compound characteristics
| Compound ID: | 4998-1096 |
| Compound Name: | 3-{[2-methoxy-6-({1-[2-(4-methylanilino)-2-oxoethyl]-2,5-dioxoimidazolidin-4-ylidene}methyl)phenoxy]methyl}benzoic acid |
| Molecular Weight: | 515.52 |
| Molecular Formula: | C28 H25 N3 O7 |
| Smiles: | Cc1ccc(cc1)NC(CN1C(/C(=C\c2cccc(c2OCc2cccc(c2)C(O)=O)OC)NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4601 |
| logD: | 1.5626 |
| logSw: | -4.5206 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 107.259 |
| InChI Key: | RNEXYVCGGGLVIO-UHFFFAOYSA-N |