N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Compound characteristics
| Compound ID: | K405-2840 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
| Molecular Weight: | 379.8 |
| Molecular Formula: | C19 H14 Cl N5 O2 |
| Smiles: | C(c1ccc2c(c1)OCO2)Nc1c2cnn(c3cccc(c3)[Cl])c2ncn1 |
| Stereo: | ACHIRAL |
| logP: | 4.186 |
| logD: | 4.1856 |
| logSw: | -4.329 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.465 |
| InChI Key: | CRVCKASUKLSSAU-UHFFFAOYSA-N |