N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[(3-cyclohexyl-3H-imidazo[4,5-b]pyridin-2-yl)methyl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[(3-cyclohexyl-3H-imidazo[4,5-b]pyridin-2-yl)methyl]sulfanyl}acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[(3-cyclohexyl-3H-imidazo[4,5-b]pyridin-2-yl)methyl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G813-0103 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[(3-cyclohexyl-3H-imidazo[4,5-b]pyridin-2-yl)methyl]sulfanyl}acetamide |
| Molecular Weight: | 438.55 |
| Molecular Formula: | C23 H26 N4 O3 S |
| Smiles: | C1CCC(CC1)n1c(CSCC(NCc2ccc3c(c2)OCO3)=O)nc2cccnc12 |
| Stereo: | ACHIRAL |
| logP: | 3.9728 |
| logD: | 3.9727 |
| logSw: | -4.0431 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.942 |
| InChI Key: | ZIHISMINSIURMN-UHFFFAOYSA-N |