{4-[4-(4-chloroanilino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]piperazin-1-yl}(furan-2-yl)methanone
Chemical Structure Depiction of
{4-[4-(4-chloroanilino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]piperazin-1-yl}(furan-2-yl)methanone
{4-[4-(4-chloroanilino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]piperazin-1-yl}(furan-2-yl)methanone
Compound characteristics
| Compound ID: | G414-0091 |
| Compound Name: | {4-[4-(4-chloroanilino)-1-methyl-1H-pyrazolo[3,4-d]pyrimidin-6-yl]piperazin-1-yl}(furan-2-yl)methanone |
| Molecular Weight: | 437.89 |
| Molecular Formula: | C21 H20 Cl N7 O2 |
| Smiles: | Cn1c2c(cn1)c(Nc1ccc(cc1)[Cl])nc(n2)N1CCN(CC1)C(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6945 |
| logD: | 3.681 |
| logSw: | -4.2066 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.624 |
| InChI Key: | KVYQMSUZDGAXBA-UHFFFAOYSA-N |