ethyl N-[4-({1-methyl-5-[(propan-2-yl)carbamoyl]-1H-benzimidazol-2-yl}methyl)piperazine-1-carbonyl]alaninate
Chemical Structure Depiction of
ethyl N-[4-({1-methyl-5-[(propan-2-yl)carbamoyl]-1H-benzimidazol-2-yl}methyl)piperazine-1-carbonyl]alaninate
ethyl N-[4-({1-methyl-5-[(propan-2-yl)carbamoyl]-1H-benzimidazol-2-yl}methyl)piperazine-1-carbonyl]alaninate
Compound characteristics
| Compound ID: | L277-0509 |
| Compound Name: | ethyl N-[4-({1-methyl-5-[(propan-2-yl)carbamoyl]-1H-benzimidazol-2-yl}methyl)piperazine-1-carbonyl]alaninate |
| Molecular Weight: | 458.56 |
| Molecular Formula: | C23 H34 N6 O4 |
| Smiles: | CCOC(C(C)NC(N1CCN(CC1)Cc1nc2cc(ccc2n1C)C(NC(C)C)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3033 |
| logD: | 1.1835 |
| logSw: | -2.4266 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.404 |
| InChI Key: | KDTNJBDLCCIVOV-INIZCTEOSA-N |