(adamantan-1-yl)[4-(1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
Chemical Structure Depiction of
(adamantan-1-yl)[4-(1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
(adamantan-1-yl)[4-(1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
Compound characteristics
| Compound ID: | V018-9853 |
| Compound Name: | (adamantan-1-yl)[4-(1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone |
| Molecular Weight: | 498.67 |
| Molecular Formula: | C30 H38 N6 O |
| Smiles: | CCCc1nc(c2cnn(c3ccccc3)c2n1)N1CCCN(CC1)C(C12CC3CC(CC(C3)C2)C1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.9102 |
| logD: | 6.8443 |
| logSw: | -5.7628 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.433 |
| InChI Key: | AKJIXXJCNUZCFZ-UHFFFAOYSA-N |