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MedKoo Cat#: 407914 | Name: BAY-1251152
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Description:

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

(+)-Enitociclib; also known as BAY-1251152, (+)-BAY-1251152, is a CDK9 inhibitor.

Chemical Structure

BAY-1251152
BAY-1251152
CAS#1610358-56-9 (rotation +)

Theoretical Analysis

MedKoo Cat#: 407914

Name: BAY-1251152

CAS#: 1610358-56-9 (rotation +)

Chemical Formula: C19H18F2N4O2S

Exact Mass: 404.1119

Molecular Weight: 404.44

Elemental Analysis: C, 56.43; H, 4.49; F, 9.40; N, 13.85; O, 7.91; S, 7.93

Price and Availability

Size Price Availability Quantity
5mg USD 450.00 2 Weeks
10mg USD 750.00 2 Weeks
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Related CAS #
1610358-53-6 (racemate) 1610358-56-9 (rotation +) 1610358-59-2 (roation -) 1610408-96-2 (R-isomer) 1610408-97-3 (S-isomer) 1610368-59-6 (R-isomer HCl) 1610368-60-9 (S-isomer HCl)
Synonym
BAY-1251152; BAY 1251152; BAY1251152; (+)-BAY-1251152; (+)-Enitociclib
IUPAC/Chemical Name
(+)-5-Fluoro-4-(4-fluoro-2-methoxyphenyl)-N-[4-[(S-methylsulfonimidoyl)methyl]pyridin-2-yl]pyridin-2-amine
InChi Key
YZCUMZWULWOUMD-UHFFFAOYSA-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)
SMILES Code
N=S(CC1=CC(NC2=NC=C(F)C(C3=CC=C(F)C=C3OC)=C2)=NC=C1)(C)=O
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
Soluble in DMSO
Shelf Life
>2 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
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
Solvent mg/mL mM
Solubility
DMSO 97.2 240.21
Note: There can be variations in solubility for the same chemical from different vendors or different batches from the same vendor. The following factors can affect the solubility of the same chemical: solvent used for crystallization, residual solvent content, polymorphism, salt versus free form, degree of hydration, solvent temperature. Please use the solubility data as a reference only. Warming and sonication will facilitate dissolving. Still have questions? Please contact our Technical Support scientists.

Preparing Stock Solutions

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.

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]. Luecking, et al. Identification of potent and highly selective PTEFb inhibitor BAY 1251152 for the treatment of cancer: from p.o. to i.v. application via scaffold hops. AACR; Cancer Res 2017;77(13 Suppl):Abstract nr 984. doi:10.1158/1538-7445.AM2017-984 https://aacrjournals.org/cancerres/article/77/13_Supplement/984/622158/Abstract-984-Identification-of-potent-and-highly [2]. WO 2014076091 A1