WARNING: This product is for research use only, not for human or veterinary use.
Hodoodo CAT#: H464979
CAS#: 1610408-97-3 (S-isomer)
Description: VIP152, also known as BAY 1251152, is a highly potent and selective CDK9 Inhibitor. VIP152 has entered clinical trials for the treatment of cancer with promising longterm, durable monotherapy activity in double-hit diffuse large B-cell lymphoma patients.
Hodoodo Cat#: H464979
Name: VIP152
CAS#: 1610408-97-3 (S-isomer)
Chemical Formula: C19H18F2N4O2S
Exact Mass: 404.11
Molecular Weight: 404.436
Elemental Analysis: C, 56.43; H, 4.49; F, 9.40; N, 13.85; O, 7.91; S, 7.93
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Related CAS #: 1610358-53-6 1610358-56-9 (rotation +) 1610358-59-2 (rotation -) 1610408-96-2 (R-isomer) 1610408-97-3 (S-isomer) 1610368-60-9 (S-isomer HCl) 1610368-59-6 (R-isomer HCl)
Synonym: Enitociclib; VIP152; VIP-152; VIP 152; BAY 1251152; BAY1251152; BAY-1251152;
IUPAC/Chemical Name: (S)-((2-((5-fluoro-4-(4-fluoro-2-methoxyphenyl)pyridin-2-yl)amino)pyridin-4-yl)methyl)(imino)(methyl)-l6-sulfanone
InChi Key: YZCUMZWULWOUMD-NDEPHWFRSA-N
InChi Code: InChI=1S/C19H18F2N4O2S/c1-27-17-8-13(20)3-4-14(17)15-9-19(24-10-16(15)21)25-18-7-12(5-6-23-18)11-28(2,22)26/h3-10,22H,11H2,1-2H3,(H,23,24,25)/t28-/m0/s1
SMILES Code: FC(C=N1)=C(C2=C(OC)C=C(F)C=C2)C=C1NC3=CC(C[S@](C)(=O)=N)=CC=N3
Appearance: Solid powder
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:
Biological target: | |
In vitro activity: | |
In vivo activity: |
The following data is based on the product molecular weight 404.44 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.
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 |
Formulation protocol: | |
In vitro protocol: | |
In vivo protocol: |
1: Lücking U, Kosemund D, Böhnke N, Lienau P, Siemeister G, Denner K, Bohlmann R, Briem H, Terebesi I, Bömer U, Schäfer M, Ince S, Mumberg D, Scholz A, Izumi R, Hwang S, von Nussbaum F. Changing for the Better: Discovery of the Highly Potent and Selective CDK9 Inhibitor VIP152 Suitable for Once Weekly Intravenous Dosing for the Treatment of Cancer. J Med Chem. 2021 Jul 15. doi: 10.1021/acs.jmedchem.1c01000. Epub ahead of print. PMID: 34264057.