4-{[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]methyl}-N-(3-ethylphenyl)benzamide
Chemical Structure Depiction of
4-{[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]methyl}-N-(3-ethylphenyl)benzamide
4-{[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]methyl}-N-(3-ethylphenyl)benzamide
Compound characteristics
| Compound ID: | G284-2146 |
| Compound Name: | 4-{[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]methyl}-N-(3-ethylphenyl)benzamide |
| Molecular Weight: | 449.56 |
| Molecular Formula: | C28 H27 N5 O |
| Smiles: | CCc1cccc(c1)NC(c1ccc(Cn2c3c(c(C)cc(C)n3)c(n2)n2cccc2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7641 |
| logD: | 5.7394 |
| logSw: | -5.7187 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.737 |
| InChI Key: | IBEMPOYKPRPITI-UHFFFAOYSA-N |