methyl 2-[(4-{[5-(dimethylcarbamoyl)-1-ethyl-1H-benzimidazol-2-yl]methyl}piperazine-1-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 2-[(4-{[5-(dimethylcarbamoyl)-1-ethyl-1H-benzimidazol-2-yl]methyl}piperazine-1-carbonyl)amino]benzoate
methyl 2-[(4-{[5-(dimethylcarbamoyl)-1-ethyl-1H-benzimidazol-2-yl]methyl}piperazine-1-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | L277-0196 |
| Compound Name: | methyl 2-[(4-{[5-(dimethylcarbamoyl)-1-ethyl-1H-benzimidazol-2-yl]methyl}piperazine-1-carbonyl)amino]benzoate |
| Molecular Weight: | 492.58 |
| Molecular Formula: | C26 H32 N6 O4 |
| Smiles: | CCn1c2ccc(cc2nc1CN1CCN(CC1)C(Nc1ccccc1C(=O)OC)=O)C(N(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7962 |
| logD: | 1.7134 |
| logSw: | -2.7028 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.626 |
| InChI Key: | UNRTYCZXLWSMEH-UHFFFAOYSA-N |