4-chloro-N-(2-{[1-(2,4-dimethylphenyl)-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)benzamide
Chemical Structure Depiction of
4-chloro-N-(2-{[1-(2,4-dimethylphenyl)-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)benzamide
4-chloro-N-(2-{[1-(2,4-dimethylphenyl)-6-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)benzamide
Compound characteristics
| Compound ID: | V026-2094 |
| Compound Name: | 4-chloro-N-(2-{[1-(2,4-dimethylphenyl)-6-methyl-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: | Cc1ccc(c(C)c1)n1c2c(cn1)c(NCCNC(c1ccc(cc1)[Cl])=O)nc(C)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.8782 |
| logD: | 4.8428 |
| logSw: | -4.8869 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.791 |
| InChI Key: | NWMHHKZRCQMSJJ-UHFFFAOYSA-N |