4-{[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]methyl}-N-[2-(4-methylphenyl)ethyl]benzamide
Chemical Structure Depiction of
4-{[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]methyl}-N-[2-(4-methylphenyl)ethyl]benzamide
4-{[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]methyl}-N-[2-(4-methylphenyl)ethyl]benzamide
Compound characteristics
| Compound ID: | G284-2131 |
| Compound Name: | 4-{[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]methyl}-N-[2-(4-methylphenyl)ethyl]benzamide |
| Molecular Weight: | 463.58 |
| Molecular Formula: | C29 H29 N5 O |
| Smiles: | Cc1ccc(CCNC(c2ccc(Cn3c4c(c(C)cc(C)n4)c(n3)n3cccc3)cc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9965 |
| logD: | 4.9718 |
| logSw: | -4.7475 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.901 |
| InChI Key: | FVIDWUFVKBBXOC-UHFFFAOYSA-N |