ethyl N-{[2-(2-methyl-1H-benzimidazol-1-yl)ethyl]carbamoyl}-beta-alaninate
Chemical Structure Depiction of
ethyl N-{[2-(2-methyl-1H-benzimidazol-1-yl)ethyl]carbamoyl}-beta-alaninate
ethyl N-{[2-(2-methyl-1H-benzimidazol-1-yl)ethyl]carbamoyl}-beta-alaninate
Compound characteristics
| Compound ID: | F120-0256 |
| Compound Name: | ethyl N-{[2-(2-methyl-1H-benzimidazol-1-yl)ethyl]carbamoyl}-beta-alaninate |
| Molecular Weight: | 318.37 |
| Molecular Formula: | C16 H22 N4 O3 |
| Smiles: | CCOC(CCNC(NCCn1c2ccccc2nc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2772 |
| logD: | 1.2676 |
| logSw: | -1.9387 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.255 |
| InChI Key: | UDQHDVPTNHNYFK-UHFFFAOYSA-N |