N-(4-{[1-(3-chlorophenyl)-6-(methoxymethyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-3-methylbutanamide
Chemical Structure Depiction of
N-(4-{[1-(3-chlorophenyl)-6-(methoxymethyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-3-methylbutanamide
N-(4-{[1-(3-chlorophenyl)-6-(methoxymethyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-3-methylbutanamide
Compound characteristics
| Compound ID: | V024-9431 |
| Compound Name: | N-(4-{[1-(3-chlorophenyl)-6-(methoxymethyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)-3-methylbutanamide |
| Molecular Weight: | 485.03 |
| Molecular Formula: | C25 H33 Cl N6 O2 |
| Salt: | not_available |
| Smiles: | CC(C)CC(NC1CCC(CC1)Nc1c2c(C)nn(c3cccc(c3)[Cl])c2nc(COC)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5093 |
| logD: | 4.447 |
| logSw: | -4.7026 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.608 |
| InChI Key: | NLCUKZWMCNRAOB-UHFFFAOYSA-N |