4-{[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]methyl}-N-[2-(thiophen-2-yl)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-(thiophen-2-yl)ethyl]benzamide
4-{[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]methyl}-N-[2-(thiophen-2-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | G284-2231 |
| Compound Name: | 4-{[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]methyl}-N-[2-(thiophen-2-yl)ethyl]benzamide |
| Molecular Weight: | 455.58 |
| Molecular Formula: | C26 H25 N5 O S |
| Smiles: | Cc1cc(C)nc2c1c(nn2Cc1ccc(cc1)C(NCCc1cccs1)=O)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5321 |
| logD: | 4.5075 |
| logSw: | -4.4412 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.919 |
| InChI Key: | HXSMBAAEXZQRKF-UHFFFAOYSA-N |