dimethyl 2-[({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)carbamamido]benzene-1,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-[({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)carbamamido]benzene-1,4-dicarboxylate
dimethyl 2-[({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)carbamamido]benzene-1,4-dicarboxylate
Compound characteristics
| Compound ID: | G331-0106 |
| Compound Name: | dimethyl 2-[({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)carbamamido]benzene-1,4-dicarboxylate |
| Molecular Weight: | 435.48 |
| Molecular Formula: | C24 H25 N3 O5 |
| Smiles: | Cc1cccc(Cn2cccc2CNC(Nc2cc(ccc2C(=O)OC)C(=O)OC)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.2717 |
| logD: | 4.2676 |
| logSw: | -4.3404 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.584 |
| InChI Key: | FSOZOKKHHNRWKF-UHFFFAOYSA-N |