4-chloro-N-(2-{[6-ethyl-3-methyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)benzamide
Chemical Structure Depiction of
4-chloro-N-(2-{[6-ethyl-3-methyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)benzamide
4-chloro-N-(2-{[6-ethyl-3-methyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)benzamide
Compound characteristics
| Compound ID: | V026-2102 |
| Compound Name: | 4-chloro-N-(2-{[6-ethyl-3-methyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)benzamide |
| Molecular Weight: | 448.95 |
| Molecular Formula: | C24 H25 Cl N6 O |
| Salt: | not_available |
| Smiles: | CCc1nc(c2c(C)nn(c3ccccc3C)c2n1)NCCNC(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4413 |
| logD: | 4.1057 |
| logSw: | -4.6364 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.521 |
| InChI Key: | ULUKWFSQERUMHM-UHFFFAOYSA-N |