3-chloro-N-[7-methyl-1-(2-methylpropyl)-1H-pyrazolo[3,4-b]quinolin-3-yl]benzamide
Chemical Structure Depiction of
3-chloro-N-[7-methyl-1-(2-methylpropyl)-1H-pyrazolo[3,4-b]quinolin-3-yl]benzamide
3-chloro-N-[7-methyl-1-(2-methylpropyl)-1H-pyrazolo[3,4-b]quinolin-3-yl]benzamide
Compound characteristics
| Compound ID: | D042-0454 |
| Compound Name: | 3-chloro-N-[7-methyl-1-(2-methylpropyl)-1H-pyrazolo[3,4-b]quinolin-3-yl]benzamide |
| Molecular Weight: | 392.89 |
| Molecular Formula: | C22 H21 Cl N4 O |
| Smiles: | CC(C)Cn1c2c(cc3ccc(C)cc3n2)c(NC(c2cccc(c2)[Cl])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.513 |
| logD: | 4.0667 |
| logSw: | -6.1713 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.639 |
| InChI Key: | VTEATGVXYIJVNB-UHFFFAOYSA-N |