ethyl 4-{[(1-benzyl-1H-pyrrol-2-yl)methyl]carbamamido}benzoate
Chemical Structure Depiction of
ethyl 4-{[(1-benzyl-1H-pyrrol-2-yl)methyl]carbamamido}benzoate
ethyl 4-{[(1-benzyl-1H-pyrrol-2-yl)methyl]carbamamido}benzoate
Compound characteristics
| Compound ID: | G331-0032 |
| Compound Name: | ethyl 4-{[(1-benzyl-1H-pyrrol-2-yl)methyl]carbamamido}benzoate |
| Molecular Weight: | 377.44 |
| Molecular Formula: | C22 H23 N3 O3 |
| Smiles: | CCOC(c1ccc(cc1)NC(NCc1cccn1Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4108 |
| logD: | 4.4108 |
| logSw: | -4.1927 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.688 |
| InChI Key: | ZHMYKRLIJYXQBG-UHFFFAOYSA-N |