4-chloro-N-(2-{[3,6-dimethyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)benzamide
Chemical Structure Depiction of
4-chloro-N-(2-{[3,6-dimethyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)benzamide
4-chloro-N-(2-{[3,6-dimethyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)benzamide
Compound characteristics
| Compound ID: | V024-5258 |
| Compound Name: | 4-chloro-N-(2-{[3,6-dimethyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)benzamide |
| Molecular Weight: | 434.93 |
| Molecular Formula: | C23 H23 Cl N6 O |
| Salt: | not_available |
| Smiles: | Cc1ccccc1n1c2c(c(C)n1)c(NCCNC(c1ccc(cc1)[Cl])=O)nc(C)n2 |
| Stereo: | ACHIRAL |
| logP: | 3.9582 |
| logD: | 3.6745 |
| logSw: | -4.538 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.144 |
| InChI Key: | PAXCFLGQNAGUKU-UHFFFAOYSA-N |