2-{4-[3-amino-4-(3-chloro-4-fluorophenyl)-2-methyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl]piperazin-1-yl}-1-(morpholin-4-yl)ethan-1-one
Chemical Structure Depiction of
2-{4-[3-amino-4-(3-chloro-4-fluorophenyl)-2-methyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl]piperazin-1-yl}-1-(morpholin-4-yl)ethan-1-one
2-{4-[3-amino-4-(3-chloro-4-fluorophenyl)-2-methyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl]piperazin-1-yl}-1-(morpholin-4-yl)ethan-1-one
Compound characteristics
| Compound ID: | V022-7645 |
| Compound Name: | 2-{4-[3-amino-4-(3-chloro-4-fluorophenyl)-2-methyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl]piperazin-1-yl}-1-(morpholin-4-yl)ethan-1-one |
| Molecular Weight: | 488.95 |
| Molecular Formula: | C22 H26 Cl F N8 O2 |
| Salt: | not_available |
| Smiles: | Cn1c(c2c(c3ccc(c(c3)[Cl])F)nc(nc2n1)N1CCN(CC1)CC(N1CCOCC1)=O)N |
| Stereo: | ACHIRAL |
| logP: | 1.3871 |
| logD: | 1.3851 |
| logSw: | -2.7727 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.084 |
| InChI Key: | QKYLWWOLZIXWON-UHFFFAOYSA-N |