N~6~-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-chlorophenyl)-4-(2-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine
Chemical Structure Depiction of
N~6~-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-chlorophenyl)-4-(2-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine
N~6~-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-chlorophenyl)-4-(2-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine
Compound characteristics
| Compound ID: | V010-6728 |
| Compound Name: | N~6~-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-chlorophenyl)-4-(2-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine |
| Molecular Weight: | 500.94 |
| Molecular Formula: | C26 H21 Cl N6 O3 |
| Salt: | not_available |
| Smiles: | COc1ccccc1c1c2c(nc(NCc3ccc4c(c3)OCO4)n1)nn(c1ccc(cc1)[Cl])c2N |
| Stereo: | ACHIRAL |
| logP: | 5.1267 |
| logD: | 5.1256 |
| logSw: | -5.5387 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.557 |
| InChI Key: | KYWYIKKNMYPKQC-UHFFFAOYSA-N |