4-[5-(methoxycarbonyl)-2-methylanilino]-4-oxobutanoic acid
Chemical Structure Depiction of
4-[5-(methoxycarbonyl)-2-methylanilino]-4-oxobutanoic acid
4-[5-(methoxycarbonyl)-2-methylanilino]-4-oxobutanoic acid
Compound characteristics
| Compound ID: | Y200-6102 |
| Compound Name: | 4-[5-(methoxycarbonyl)-2-methylanilino]-4-oxobutanoic acid |
| Molecular Weight: | 265.26 |
| Molecular Formula: | C13 H15 N O5 |
| Smiles: | Cc1ccc(cc1NC(CCC(O)=O)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 0.8422 |
| logD: | -2.1072 |
| logSw: | -1.8744 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.248 |
| InChI Key: | LNYCZGQTXSYGJX-UHFFFAOYSA-N |