N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{[2-(benzylsulfanyl)-3H-imidazo[4,5-b]pyridin-3-yl]methyl}benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{[2-(benzylsulfanyl)-3H-imidazo[4,5-b]pyridin-3-yl]methyl}benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{[2-(benzylsulfanyl)-3H-imidazo[4,5-b]pyridin-3-yl]methyl}benzamide
Compound characteristics
| Compound ID: | C797-1558 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{[2-(benzylsulfanyl)-3H-imidazo[4,5-b]pyridin-3-yl]methyl}benzamide |
| Molecular Weight: | 508.6 |
| Molecular Formula: | C29 H24 N4 O3 S |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(c1ccc(Cn2c(nc3cccnc23)SCc2ccccc2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9383 |
| logD: | 4.9375 |
| logSw: | -5.0446 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.913 |
| InChI Key: | RTKFULFGROAHMV-UHFFFAOYSA-N |