MedKoo Cat#: 207196 | Name: Atirmociclib
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Description:

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

Atirmociclib, also kn own as PF-07220060 is a novel potent oral CDK4-selective inhibitor. It exhibits potent inhibitory activity with dissociation constants (Ki) of 0.6 nM for the CDK4/Cyclin D1 complex and 13.9 nM for the CDK6/Cyclin D3 complex. Its mechanism involves inhibiting the CDK4/Cyclin D complex, thereby preventing phosphorylation of the retinoblastoma (Rb) protein, leading to cell cycle arrest in the G1 phase and potential antineoplastic effects.

Chemical Structure

Atirmociclib
Atirmociclib
CAS#2380321-51-5

Theoretical Analysis

MedKoo Cat#: 207196

Name: Atirmociclib

CAS#: 2380321-51-5

Chemical Formula: C22H27ClFN5O3

Exact Mass: 463.1786

Molecular Weight: 463.94

Elemental Analysis: C, 56.96; H, 5.87; Cl, 7.64; F, 4.10; N, 15.10; O, 10.35

Price and Availability

Size Price Availability Quantity
25mg USD 750.00 2 months
50mg USD 1,150.00 2 months
100mg USD 1,750.00 2 months
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Related CAS #
No Data
Synonym
PF-07220060; PF 07220060; PF07220060; atirmociclib; CDK4/6-IN-6
IUPAC/Chemical Name
(3S,4R)-4-((5-chloro-4-(4-fluoro-2-(2-hydroxypropan-2-yl)-1-isopropyl-1H-benzo[d]imidazol-6-yl)pyrimidin-2-yl)amino)tetrahydro-2H-pyran-3-ol
InChi Key
QYJLBHRAPDJOSO-NVXWUHKLSA-N
InChi Code
InChI=1S/C22H27ClFN5O3/c1-11(2)29-16-8-12(7-14(24)19(16)27-20(29)22(3,4)31)18-13(23)9-25-21(28-18)26-15-5-6-32-10-17(15)30/h7-9,11,15,17,30-31H,5-6,10H2,1-4H3,(H,25,26,28)/t15-,17-/m1/s1
SMILES Code
CC(N1C2=CC(C3=NC(N[C@H]4[C@@H](COCC4)O)=NC=C3Cl)=CC(F)=C2N=C1C(C)(O)C)C
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 463.94 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
[1]. Ping Chen, et al. 2-amino-pyridine or 2-amino-pyrimidine derivatives as cyclin dependent kinase inhibitors. WO2019207463A1. https://patents.google.com/patent/WO2019207463A1/en?oq=WO2019207463