N-[2-(cyclohex-1-en-1-yl)ethyl]-4-{[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]methyl}benzamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-4-{[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]methyl}benzamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-4-{[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]methyl}benzamide
Compound characteristics
| Compound ID: | G284-2164 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-4-{[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]methyl}benzamide |
| Molecular Weight: | 453.59 |
| Molecular Formula: | C28 H31 N5 O |
| Smiles: | Cc1cc(C)nc2c1c(nn2Cc1ccc(cc1)C(NCCC1CCCCC=1)=O)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9435 |
| logD: | 4.9189 |
| logSw: | -4.7412 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.093 |
| InChI Key: | BEEFWXGVRSNAEN-UHFFFAOYSA-N |