2-chloro-N-(4-{[6-(methoxymethyl)-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)benzamide
Chemical Structure Depiction of
2-chloro-N-(4-{[6-(methoxymethyl)-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)benzamide
2-chloro-N-(4-{[6-(methoxymethyl)-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)benzamide
Compound characteristics
| Compound ID: | V024-9894 |
| Compound Name: | 2-chloro-N-(4-{[6-(methoxymethyl)-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)benzamide |
| Molecular Weight: | 519.05 |
| Molecular Formula: | C28 H31 Cl N6 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)n1c2c(c(C)n1)c(NC1CCC(CC1)NC(c1ccccc1[Cl])=O)nc(COC)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.1385 |
| logD: | 5.0763 |
| logSw: | -5.3184 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.55 |
| InChI Key: | RSHDYIAPOVLFRL-UHFFFAOYSA-N |