6-benzyl-4-[4-(butane-1-sulfonyl)piperazin-1-yl]-1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidine
Chemical Structure Depiction of
6-benzyl-4-[4-(butane-1-sulfonyl)piperazin-1-yl]-1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidine
6-benzyl-4-[4-(butane-1-sulfonyl)piperazin-1-yl]-1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidine
Compound characteristics
| Compound ID: | V002-4930 |
| Compound Name: | 6-benzyl-4-[4-(butane-1-sulfonyl)piperazin-1-yl]-1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidine |
| Molecular Weight: | 525.07 |
| Molecular Formula: | C26 H29 Cl N6 O2 S |
| Salt: | not_available |
| Smiles: | CCCCS(N1CCN(CC1)c1c2cnn(c3cccc(c3)[Cl])c2nc(Cc2ccccc2)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8042 |
| logD: | 5.7938 |
| logSw: | -5.9011 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.026 |
| InChI Key: | YPXHKFRIZGPFAP-UHFFFAOYSA-N |