3-(1H-benzimidazol-2-yl)-6-ethyl-7-hydroxy-8-[(3-methylpiperidin-1-yl)methyl]-4H-1-benzopyran-4-one
Chemical Structure Depiction of
3-(1H-benzimidazol-2-yl)-6-ethyl-7-hydroxy-8-[(3-methylpiperidin-1-yl)methyl]-4H-1-benzopyran-4-one
3-(1H-benzimidazol-2-yl)-6-ethyl-7-hydroxy-8-[(3-methylpiperidin-1-yl)methyl]-4H-1-benzopyran-4-one
Compound characteristics
Compound ID: | 6737-0967 |
Compound Name: | 3-(1H-benzimidazol-2-yl)-6-ethyl-7-hydroxy-8-[(3-methylpiperidin-1-yl)methyl]-4H-1-benzopyran-4-one |
Molecular Weight: | 417.51 |
Molecular Formula: | C25 H27 N3 O3 |
Smiles: | CCc1cc2C(C(=COc2c(CN2CCCC(C)C2)c1O)c1nc2ccccc2[nH]1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.5643 |
logD: | 3.3692 |
logSw: | -4.2087 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 58.98 |
InChI Key: | IZHHXDOFPJSZLO-HNNXBMFYSA-N |