4-{[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]methyl}-N-({4-[(propan-2-yl)oxy]phenyl}methyl)benzamide
Chemical Structure Depiction of
4-{[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]methyl}-N-({4-[(propan-2-yl)oxy]phenyl}methyl)benzamide
4-{[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]methyl}-N-({4-[(propan-2-yl)oxy]phenyl}methyl)benzamide
Compound characteristics
| Compound ID: | G284-2235 |
| Compound Name: | 4-{[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]methyl}-N-({4-[(propan-2-yl)oxy]phenyl}methyl)benzamide |
| Molecular Weight: | 493.61 |
| Molecular Formula: | C30 H31 N5 O2 |
| Smiles: | CC(C)Oc1ccc(CNC(c2ccc(Cn3c4c(c(C)cc(C)n4)c(n3)n3cccc3)cc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3061 |
| logD: | 5.2814 |
| logSw: | -5.4392 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.862 |
| InChI Key: | SKRQRTDEWSTCHF-UHFFFAOYSA-N |