BGC > Produktsuche > Ibrutinib Impurity 1 | 1022150-11-3

Molecular Formula: C27H30N6O3
Molecular Weight: 486.5655

Description:
An impurity of Ibrutinib, a medication used to treat refractory chronic lymphocytic leukemia (CLL) and mantle cell lymphoma.

• Molecular Weight:486.58
• Melting Point:103-106°C
• Purity:> 95%

Molecular Formula:
C27H30N6O3
Canonical SMILES:
CC(C)(C)OC(=O)N1CCCC(C1)N2C3=NC=NC(=C3C(=N2)C4=CC=C(C=C4)OC5=CC=CC=C5)N
InChI:
InChI=1S/C27H30N6O3/c1-27(2,3)36-26(34)32-15-7-8-19(16-32)33-25-22(24(28)29-17-30-25)23(31-33)18-11-13-21(14-12-18)35-20-9-5-4-6-10-20/h4-6,9-14,17,19H,7-8,15-16H2,1-3H3,(H2,28,29,30)/t19-/m1/s1
InChIKey:
NTSAEGNFPKKRLX-LJQANCHMSA-N
Appearance:
White to Off-White Solid
Synonyms:
1-Piperidinecarboxylic acid, 3-[4-aMino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyriMidin-1-yl]-, 1,1-diMethylethyl ester, (3R)-; (R)-tert-Butyl 3-[4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]piperidine-1-carboxylate

Purity: 97%
Smile code: O=C(N1C[C@H](N2N=C(C3=CC=C(OC4=CC=CC=C4)C=C3)C5=C(N)N=CN=C52)CCC1)OC(C)(C)C
MDL Number: MFCD28167899
MolFormula: C27H30N6O3
MolWeight: 486.5655
Available in stock: 41.25

Smile code:
O=C(N1C[C@H](N2N=C(C3=CC=C(OC4=CC=CC=C4)C=C3)C5=C(N)N=CN=C52)CCC1)OC(C)(C)C
MDL Number:
MFCD28167899
Purity :
97%
Available in stock:
10.3 g