(4-tert-butylphenyl){4-[6-(oxan-4-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
Chemical Structure Depiction of
(4-tert-butylphenyl){4-[6-(oxan-4-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
(4-tert-butylphenyl){4-[6-(oxan-4-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
Compound characteristics
| Compound ID: | V020-2620 |
| Compound Name: | (4-tert-butylphenyl){4-[6-(oxan-4-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone |
| Molecular Weight: | 538.69 |
| Molecular Formula: | C32 H38 N6 O2 |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1ccc(cc1)C(N1CCCN(CC1)c1c2cnn(c3ccccc3)c2nc(C2CCOCC2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4249 |
| logD: | 6.4092 |
| logSw: | -5.6022 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 61.238 |
| InChI Key: | YQLZIOLGEBDMRN-UHFFFAOYSA-N |