N-(2-{[1-(3-chlorophenyl)-6-cyclopropyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-3-fluorobenzamide
Chemical Structure Depiction of
N-(2-{[1-(3-chlorophenyl)-6-cyclopropyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-3-fluorobenzamide
N-(2-{[1-(3-chlorophenyl)-6-cyclopropyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-3-fluorobenzamide
Compound characteristics
| Compound ID: | V028-7577 |
| Compound Name: | N-(2-{[1-(3-chlorophenyl)-6-cyclopropyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)-3-fluorobenzamide |
| Molecular Weight: | 450.9 |
| Molecular Formula: | C23 H20 Cl F N6 O |
| Salt: | not_available |
| Smiles: | C1CC1c1nc(c2cnn(c3cccc(c3)[Cl])c2n1)NCCNC(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7773 |
| logD: | 4.4423 |
| logSw: | -4.9884 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.73 |
| InChI Key: | RLQFRZQCGHWQCQ-UHFFFAOYSA-N |