ethyl N-[4-(1-methyl-1H-benzimidazol-2-yl)piperazine-1-carbonyl]-beta-alaninate
Chemical Structure Depiction of
ethyl N-[4-(1-methyl-1H-benzimidazol-2-yl)piperazine-1-carbonyl]-beta-alaninate
ethyl N-[4-(1-methyl-1H-benzimidazol-2-yl)piperazine-1-carbonyl]-beta-alaninate
Compound characteristics
| Compound ID: | L053-0181 |
| Compound Name: | ethyl N-[4-(1-methyl-1H-benzimidazol-2-yl)piperazine-1-carbonyl]-beta-alaninate |
| Molecular Weight: | 359.43 |
| Molecular Formula: | C18 H25 N5 O3 |
| Smiles: | [H]c1cc2c(cc1[H])n(C)c(n2)N1CCN(CC1)C(NCCC(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9698 |
| logD: | 1.6966 |
| logSw: | -2.3295 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.113 |
| InChI Key: | ZOQIPRKTSRQMDJ-UHFFFAOYSA-N |