ethyl N-({2-[2-(4-methylphenyl)-1H-benzimidazol-1-yl]ethyl}carbamoyl)-beta-alaninate
Chemical Structure Depiction of
ethyl N-({2-[2-(4-methylphenyl)-1H-benzimidazol-1-yl]ethyl}carbamoyl)-beta-alaninate
ethyl N-({2-[2-(4-methylphenyl)-1H-benzimidazol-1-yl]ethyl}carbamoyl)-beta-alaninate
Compound characteristics
| Compound ID: | F120-0169 |
| Compound Name: | ethyl N-({2-[2-(4-methylphenyl)-1H-benzimidazol-1-yl]ethyl}carbamoyl)-beta-alaninate |
| Molecular Weight: | 394.47 |
| Molecular Formula: | C22 H26 N4 O3 |
| Smiles: | CCOC(CCNC(NCCn1c2ccccc2nc1c1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6352 |
| logD: | 3.6304 |
| logSw: | -3.6505 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.206 |
| InChI Key: | UUZZUJNROPLECB-UHFFFAOYSA-N |