methyl 2-{[5-benzamido-2-(pyrrolidin-1-yl)phenyl]carbamamido}-4-methylbenzoate
Chemical Structure Depiction of
methyl 2-{[5-benzamido-2-(pyrrolidin-1-yl)phenyl]carbamamido}-4-methylbenzoate
methyl 2-{[5-benzamido-2-(pyrrolidin-1-yl)phenyl]carbamamido}-4-methylbenzoate
Compound characteristics
Compound ID: | F694-0844 |
Compound Name: | methyl 2-{[5-benzamido-2-(pyrrolidin-1-yl)phenyl]carbamamido}-4-methylbenzoate |
Molecular Weight: | 472.54 |
Molecular Formula: | C27 H28 N4 O4 |
Smiles: | Cc1ccc(C(=O)OC)c(c1)NC(Nc1cc(ccc1N1CCCC1)NC(c1ccccc1)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.9026 |
logD: | 4.9018 |
logSw: | -4.6454 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 78.928 |
InChI Key: | DGVGPWSGCOYURZ-UHFFFAOYSA-N |