N-(4-{[1-(3-chlorophenyl)-6-(methoxymethyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)propanamide
Chemical Structure Depiction of
N-(4-{[1-(3-chlorophenyl)-6-(methoxymethyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)propanamide
N-(4-{[1-(3-chlorophenyl)-6-(methoxymethyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)propanamide
Compound characteristics
| Compound ID: | V024-9442 |
| Compound Name: | N-(4-{[1-(3-chlorophenyl)-6-(methoxymethyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}cyclohexyl)propanamide |
| Molecular Weight: | 456.97 |
| Molecular Formula: | C23 H29 Cl N6 O2 |
| Salt: | not_available |
| Smiles: | CCC(NC1CCC(CC1)Nc1c2c(C)nn(c3cccc(c3)[Cl])c2nc(COC)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5127 |
| logD: | 3.4505 |
| logSw: | -3.7778 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.608 |
| InChI Key: | UBERMHNDLMFHLV-UHFFFAOYSA-N |