N-(2-{[3,6-dimethyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-2-fluorobenzamide
Chemical Structure Depiction of
N-(2-{[3,6-dimethyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-2-fluorobenzamide
N-(2-{[3,6-dimethyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-2-fluorobenzamide
Compound characteristics
| Compound ID: | V007-9573 |
| Compound Name: | N-(2-{[3,6-dimethyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-2-fluorobenzamide |
| Molecular Weight: | 418.47 |
| Molecular Formula: | C23 H23 F N6 O |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)n1c2c(c(C)n1)c(NCCNC(c1ccccc1F)=O)nc(C)n2 |
| Stereo: | ACHIRAL |
| logP: | 3.7529 |
| logD: | 3.3032 |
| logSw: | -4.1623 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.445 |
| InChI Key: | YVICDIHDXXRBSY-UHFFFAOYSA-N |