methyl 4-[2-(1-benzyl-1H-pyrrol-2-yl)(oxo)acetamido]benzoate
Chemical Structure Depiction of
methyl 4-[2-(1-benzyl-1H-pyrrol-2-yl)(oxo)acetamido]benzoate
methyl 4-[2-(1-benzyl-1H-pyrrol-2-yl)(oxo)acetamido]benzoate
Compound characteristics
| Compound ID: | L793-3357 |
| Compound Name: | methyl 4-[2-(1-benzyl-1H-pyrrol-2-yl)(oxo)acetamido]benzoate |
| Molecular Weight: | 362.38 |
| Molecular Formula: | C21 H18 N2 O4 |
| Smiles: | COC(c1ccc(cc1)NC(C(c1cccn1Cc1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0164 |
| logD: | 4.009 |
| logSw: | -4.254 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.832 |
| InChI Key: | DVCSHCWQCYDZBM-UHFFFAOYSA-N |