ACALABRUTINIB IMPURITY 14
On Request
Molecular Formula
C47H42N12O3
Molecular Weight
822.9315
CAS Number
N/A
PubChem CID
N/A
IUPAC Name
4-(8-Amino-3-((1R)-2-((S)-2-(8-amino-1-(4-(phenylcarbamoyl)phenyl)imidazo[1,5-a]pyrazin-3-yl)pyrrolidine-1-carbonyl)cyclopentyl)imida...
🔬 Chemical Identifiers
NC=1C=2N(C=CN1)C(=NC2C2=CC=C(C(=O)NC1=NC=CC=C1)C=C2)[C@H]2C(CCC2)C(=O)N2[C@@H](CCC2)C2=NC(=C1N2C=CN=C1N)C1=CC=C(C=C1)C(NC1=CC=CC=C1)=O
InChI=1/C47H42N12O3/c48-41-39-37(28-16-20-31(21-17-28)46(61)54-36-13-4-5-22-50-36)55-43(58(39)26-23-51-41)33-10-6-11-34(33)47(62)57-25-7-12-35(57)44-56-38(40-42(49)52-24-27-59(40)44)29-14-18-30(19-15-29)45(60)53-32-8-2-1-3-9-32/h1-5,8-9,13-24,26-27,33-35H,6-7,10-12,25H2,(H2,48,51)(H2,49,52)(H,53,60)(H,50,54,61)/t33-,34?,35+/m1/s1/f/h53-54H,48-49H2
RWPMKOOXFGBZPT-GWWWGVLJSA-N
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