2-chloro-N-(4-{[3,6-dimethyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)benzamide
Chemical Structure Depiction of
2-chloro-N-(4-{[3,6-dimethyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)benzamide
2-chloro-N-(4-{[3,6-dimethyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)benzamide
Compound characteristics
| Compound ID: | V026-7131 |
| Compound Name: | 2-chloro-N-(4-{[3,6-dimethyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)benzamide |
| Molecular Weight: | 489.02 |
| Molecular Formula: | C27 H29 Cl N6 O |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)n1c2c(c(C)n1)c(NC1CCC(CC1)NC(c1ccccc1[Cl])=O)nc(C)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.4972 |
| logD: | 5.1395 |
| logSw: | -5.8324 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.748 |
| InChI Key: | DXLFJWBBHQOLGT-UHFFFAOYSA-N |