4-{1-[2-(azepan-1-yl)-2-oxoethyl]-1H-benzimidazol-2-yl}-1-(3-methoxyphenyl)pyrrolidin-2-one
Chemical Structure Depiction of
4-{1-[2-(azepan-1-yl)-2-oxoethyl]-1H-benzimidazol-2-yl}-1-(3-methoxyphenyl)pyrrolidin-2-one
4-{1-[2-(azepan-1-yl)-2-oxoethyl]-1H-benzimidazol-2-yl}-1-(3-methoxyphenyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | D347-2880 |
| Compound Name: | 4-{1-[2-(azepan-1-yl)-2-oxoethyl]-1H-benzimidazol-2-yl}-1-(3-methoxyphenyl)pyrrolidin-2-one |
| Molecular Weight: | 446.55 |
| Molecular Formula: | C26 H30 N4 O3 |
| Smiles: | COc1cccc(c1)N1CC(CC1=O)c1nc2ccccc2n1CC(N1CCCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8951 |
| logD: | 3.8949 |
| logSw: | -4.0166 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.913 |
| InChI Key: | SBMKAUHOEPJKDG-LJQANCHMSA-N |