N~6~-butyl-N~4~-(3-chloro-4-methoxyphenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
Chemical Structure Depiction of
N~6~-butyl-N~4~-(3-chloro-4-methoxyphenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
N~6~-butyl-N~4~-(3-chloro-4-methoxyphenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine
Compound characteristics
| Compound ID: | E781-0250 |
| Compound Name: | N~6~-butyl-N~4~-(3-chloro-4-methoxyphenyl)-1-methyl-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine |
| Molecular Weight: | 360.84 |
| Molecular Formula: | C17 H21 Cl N6 O |
| Smiles: | CCCCNc1nc(c2cnn(C)c2n1)Nc1ccc(c(c1)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 4.3929 |
| logD: | 4.3839 |
| logSw: | -4.5209 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.322 |
| InChI Key: | HMZPZMXITWBIBX-UHFFFAOYSA-N |