N-(2-{[1-(3-chlorophenyl)-6-cyclohexyl-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)furan-2-carboxamide
Chemical Structure Depiction of
N-(2-{[1-(3-chlorophenyl)-6-cyclohexyl-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)furan-2-carboxamide
N-(2-{[1-(3-chlorophenyl)-6-cyclohexyl-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)furan-2-carboxamide
Compound characteristics
Compound ID: | V027-6355 |
Compound Name: | N-(2-{[1-(3-chlorophenyl)-6-cyclohexyl-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)furan-2-carboxamide |
Molecular Weight: | 478.98 |
Molecular Formula: | C25 H27 Cl N6 O2 |
Salt: | not_available |
Smiles: | Cc1c2c(NCCNC(c3ccco3)=O)nc(C3CCCCC3)nc2n(c2cccc(c2)[Cl])n1 |
Stereo: | ACHIRAL |
logP: | 4.8089 |
logD: | 4.5344 |
logSw: | -4.9047 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 77.331 |
InChI Key: | MMGWVGBFBZRDAQ-UHFFFAOYSA-N |