methyl 2-{[5-(4-methylbenzamido)-2-(pyrrolidin-1-yl)phenyl]carbamamido}benzoate
Chemical Structure Depiction of
methyl 2-{[5-(4-methylbenzamido)-2-(pyrrolidin-1-yl)phenyl]carbamamido}benzoate
methyl 2-{[5-(4-methylbenzamido)-2-(pyrrolidin-1-yl)phenyl]carbamamido}benzoate
Compound characteristics
| Compound ID: | F694-0683 |
| Compound Name: | methyl 2-{[5-(4-methylbenzamido)-2-(pyrrolidin-1-yl)phenyl]carbamamido}benzoate |
| Molecular Weight: | 472.54 |
| Molecular Formula: | C27 H28 N4 O4 |
| Smiles: | Cc1ccc(cc1)C(Nc1ccc(c(c1)NC(Nc1ccccc1C(=O)OC)=O)N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3523 |
| logD: | 5.3511 |
| logSw: | -5.299 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.928 |
| InChI Key: | BUFRTTLURYKBGH-UHFFFAOYSA-N |