1-(3-chloro-4-methylphenyl)-N-{3-[(propan-2-yl)oxy]propyl}-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Chemical Structure Depiction of
1-(3-chloro-4-methylphenyl)-N-{3-[(propan-2-yl)oxy]propyl}-1H-pyrazolo[3,4-d]pyrimidin-4-amine
1-(3-chloro-4-methylphenyl)-N-{3-[(propan-2-yl)oxy]propyl}-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Compound characteristics
| Compound ID: | K405-3166 |
| Compound Name: | 1-(3-chloro-4-methylphenyl)-N-{3-[(propan-2-yl)oxy]propyl}-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
| Molecular Weight: | 359.86 |
| Molecular Formula: | C18 H22 Cl N5 O |
| Smiles: | CC(C)OCCCNc1c2cnn(c3ccc(C)c(c3)[Cl])c2ncn1 |
| Stereo: | ACHIRAL |
| logP: | 4.4777 |
| logD: | 4.4772 |
| logSw: | -4.3006 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.664 |
| InChI Key: | ZSFCVACUGQPSPC-UHFFFAOYSA-N |