Primary record
Acalabrutinib
- CAS
- 1420477-60-6
- PubChem CID
- 71226662
- SMILES
- CC#CC(=O)N1CCC[C@H]1C2=NC(=C3N2C=CN=C3N)C4=CC=C(C=C4)C(=O)NC5=CC=CC=N5
- Molecular Formula
- C26H23N7O2
- Molecular Weight
- 465.517
- Exact Mass
- 465.1913
- InChI
- InChI=1S/C26H23N7O2/c1-2-6-21(34)32-15-5-7-19(32)25-31-22(23-24(27)29-14-16-33(23)25)17-9-11-18(12-10-17)26(35)30-20-8-3-4-13-28-20/h3-4,8-14,16,19H,5,7,15H2,1H3,(H2,27,29)(H,28,30,35)/t19-/m0/s1
- InChIKey
- WDENQIQQYWYTPO-IBGZPJMESA-N
- LogP
- 3.3126
- TPSA
- 118.51
Names and synonyms
- Acalabrutinib
- Calquence
- 1420477-60-6
- acalabrutinibum
- ACP-196
- Acalabrutinib [INN]
- Calquence (TN)
- Acalabrutinib (ACP-196)
- Acalabrutinib(ACP196)
- Acalabrutinib enantiomer
- RefChem:57414
- Acalabrutinib (Standard)
- Acalabrutinib [USAN:INN]
- ACP-196;Acalabrutinib
- I42748ELQW
- UNII-I42748ELQW
- ACALABRUTINIB [MI]
- MFCD29472294
- ACALABRUTINIB [JAN]
- ACALABRUTINIB [USAN]
- CHEBI:167707
- ACALABRUTINIB [WHO-DD]
- ACP196
- DTXSID401026209
- GTPL8912
- orb1303984
- Acalabrutinib (JAN/USAN/INN)
- CHEMBL3707348
- SCHEMBL14637368
- SCHEMBL29376537