4-{1-[2-(azepan-1-yl)-2-oxoethyl]-1H-benzimidazol-2-yl}-1-(4-butylphenyl)pyrrolidin-2-one
Chemical Structure Depiction of
4-{1-[2-(azepan-1-yl)-2-oxoethyl]-1H-benzimidazol-2-yl}-1-(4-butylphenyl)pyrrolidin-2-one
4-{1-[2-(azepan-1-yl)-2-oxoethyl]-1H-benzimidazol-2-yl}-1-(4-butylphenyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | D347-2444 |
| Compound Name: | 4-{1-[2-(azepan-1-yl)-2-oxoethyl]-1H-benzimidazol-2-yl}-1-(4-butylphenyl)pyrrolidin-2-one |
| Molecular Weight: | 472.63 |
| Molecular Formula: | C29 H36 N4 O2 |
| Smiles: | CCCCc1ccc(cc1)N1CC(CC1=O)c1nc2ccccc2n1CC(N1CCCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7255 |
| logD: | 5.7253 |
| logSw: | -5.3028 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.369 |
| InChI Key: | YQLXQGFOZYFBNT-HSZRJFAPSA-N |