methyl 4-[(2-{[(4-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]benzoate
Chemical Structure Depiction of
methyl 4-[(2-{[(4-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]benzoate
methyl 4-[(2-{[(4-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]benzoate
Compound characteristics
| Compound ID: | C797-1035 |
| Compound Name: | methyl 4-[(2-{[(4-methylphenyl)methyl]sulfanyl}-3H-imidazo[4,5-c]pyridin-3-yl)methyl]benzoate |
| Molecular Weight: | 403.5 |
| Molecular Formula: | C23 H21 N3 O2 S |
| Smiles: | Cc1ccc(CSc2nc3ccncc3n2Cc2ccc(cc2)C(=O)OC)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0779 |
| logD: | 5.0748 |
| logSw: | -4.5486 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.169 |
| InChI Key: | LXJANCNZQZIWOS-UHFFFAOYSA-N |