2-({1-[(4-methylphenyl)methyl]-1H-pyrrolo[3,2-c]pyridin-4-yl}sulfanyl)-N-(3,4,5-trimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-({1-[(4-methylphenyl)methyl]-1H-pyrrolo[3,2-c]pyridin-4-yl}sulfanyl)-N-(3,4,5-trimethoxyphenyl)acetamide
2-({1-[(4-methylphenyl)methyl]-1H-pyrrolo[3,2-c]pyridin-4-yl}sulfanyl)-N-(3,4,5-trimethoxyphenyl)acetamide
Compound characteristics
Compound ID: | M046-0480 |
Compound Name: | 2-({1-[(4-methylphenyl)methyl]-1H-pyrrolo[3,2-c]pyridin-4-yl}sulfanyl)-N-(3,4,5-trimethoxyphenyl)acetamide |
Molecular Weight: | 477.58 |
Molecular Formula: | C26 H27 N3 O4 S |
Smiles: | Cc1ccc(Cn2ccc3c(nccc23)SCC(Nc2cc(c(c(c2)OC)OC)OC)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 4.1221 |
logD: | 4.1209 |
logSw: | -4.1899 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.112 |
InChI Key: | PXYSJWMKDRKOOO-UHFFFAOYSA-N |