N-(2-{[3,6-dimethyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)furan-2-carboxamide
Chemical Structure Depiction of
N-(2-{[3,6-dimethyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)furan-2-carboxamide
N-(2-{[3,6-dimethyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)furan-2-carboxamide
Compound characteristics
| Compound ID: | V026-9183 |
| Compound Name: | N-(2-{[3,6-dimethyl-1-(3-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino}ethyl)furan-2-carboxamide |
| Molecular Weight: | 390.44 |
| Molecular Formula: | C21 H22 N6 O2 |
| Smiles: | Cc1cccc(c1)n1c2c(c(C)n1)c(NCCNC(c1ccco1)=O)nc(C)n2 |
| Stereo: | ACHIRAL |
| logP: | 2.6287 |
| logD: | 2.179 |
| logSw: | -2.9605 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.023 |
| InChI Key: | CBGXWLHWUSLMHQ-UHFFFAOYSA-N |