Catalog Number:
AG00ABJ5
Chemical Name:
Btk Inhibitor 1 R-Enantiomer Hydrochloride
CAS Number:
1553977-42-6
Molecular Formula:
C22H23ClN6O
Molecular Weight:
422.9106
MDL Number:
MFCD28167750
IUPAC Name:
3-(4-phenoxyphenyl)-1-[(3R)-piperidin-3-yl]pyrazolo[3,4-d]pyrimidin-4-amine;hydrochloride
InChI:
InChI=1S/C22H22N6O.ClH/c23-21-19-20(15-8-10-18(11-9-15)29-17-6-2-1-3-7-17)27-28(22(19)26-14-25-21)16-5-4-12-24-13-16;/h1-3,6-11,14,16,24H,4-5,12-13H2,(H2,23,25,26);1H/t16-;/m1./s1
InChI Key:
ATLAMSZMAHXMSQ-PKLMIRHRSA-N
SMILES:
Nc1ncnc2c1c(nn2[C@@H]1CCCNC1)c1ccc(cc1)Oc1ccccc1.Cl
