MedKoo Cat#: 122158 | Name: IBT6A
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Description:

WARNING: This product is for research use only, not for human or veterinary use.

IBT6A is a Btk kinase inhibitor. This compound is a precurser for the manufacture of ibrutinib.

Chemical Structure

IBT6A
IBT6A
CAS#1022150-12-4

Theoretical Analysis

MedKoo Cat#: 122158

Name: IBT6A

CAS#: 1022150-12-4

Chemical Formula: C22H22N6O

Exact Mass: 386.1855

Molecular Weight: 386.46

Elemental Analysis: C, 68.38; H, 5.74; N, 21.75; O, 4.14

Price and Availability

Size Price Availability Quantity
1g USD 250.00 2 Weeks
5g USD 650.00 2 Weeks
10g USD 950.00 2 Weeks
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Related CAS #
No Data
Synonym
IBT6A
IUPAC/Chemical Name
(R)-3-(4-phenoxyphenyl)-1-(piperidin-3-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
InChi Key
GPSQYTDPBDNDGI-MRXNPFEDSA-N
InChi Code
InChI=1S/C22H22N6O/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)/t16-/m1/s1
SMILES Code
NC1=NC=NC2=C1C(C(C=C3)=CC=C3OC4=CC=CC=C4)=NN2[C@@H]5CCCNC5
Appearance
To be determined
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 386.46 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL