ethyl N-(4-{[1-methyl-5-(pyrrolidine-1-carbonyl)-1H-benzimidazol-2-yl]methyl}piperazine-1-carbonyl)-beta-alaninate
Chemical Structure Depiction of
ethyl N-(4-{[1-methyl-5-(pyrrolidine-1-carbonyl)-1H-benzimidazol-2-yl]methyl}piperazine-1-carbonyl)-beta-alaninate
ethyl N-(4-{[1-methyl-5-(pyrrolidine-1-carbonyl)-1H-benzimidazol-2-yl]methyl}piperazine-1-carbonyl)-beta-alaninate
Compound characteristics
| Compound ID: | L277-0102 |
| Compound Name: | ethyl N-(4-{[1-methyl-5-(pyrrolidine-1-carbonyl)-1H-benzimidazol-2-yl]methyl}piperazine-1-carbonyl)-beta-alaninate |
| Molecular Weight: | 470.57 |
| Molecular Formula: | C24 H34 N6 O4 |
| Smiles: | CCOC(CCNC(N1CCN(CC1)Cc1nc2cc(ccc2n1C)C(N1CCCC1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8065 |
| logD: | 0.3618 |
| logSw: | -2.1189 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.843 |
| InChI Key: | NZXGTVZEOLPHHO-UHFFFAOYSA-N |