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Screening compounds

Cdk12-IN-E9

Also known as (S)-N-(3-((3-Ethyl-5-(2-(2-hydroxyethyl)piperidin-1-yl)pyrazolo[1,5-a]pyrimidin-7-yl)amino)phenyl)acrylamide, N-[3-({3-ethyl-5-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]pyrazolo[1,5-a]pyrimidin-7-yl}amino)phenyl]prop-2-enamide, N-[3-[[3-ethyl-5-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]pyrazolo[1,5-a]pyrimidin-7-yl]amino]phenyl]prop-2-enamide

CAS 2020052-55-3Formula C24H30N6O2Molar mass 434.54 g/mol
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Cdk12-IN-E9 chemical structure, C24H30N6O2, CAS 2020052-55-3
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
2020052-55-3
Formula
C24H30N6O2
Molar mass
434.54 g/mol
HS code
293359
Category
Screening compounds

What is Cdk12-IN-E9?

Plain description, key identifiers and synonyms

Cdk12-IN-E9 is a chemical substance with the molecular formula C24H30N6O2 and a molar mass of 434.54 g/mol. Its CAS registry number is 2020052-55-3. The IUPAC name is N-[3-[[3-ethyl-5-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]pyrazolo[1,5-a]pyrimidin-7-yl]amino]phenyl]prop-2-enamide.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
N-[3-[[3-ethyl-5-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]pyrazolo[1,5-a]pyrimidin-7-yl]amino]phenyl]prop-2-enamide
CAS number
2020052-55-3Other or deprecated CAS: 2020052-51-9
Molecular formula
C24H30N6O2
InChIKey
CDCHESFKYUNJPV-FQEVSTJZSA-N
InChI
InChI=1S/C24H30N6O2/c1-3-17-16-25-30-22(26-18-8-7-9-19(14-18)27-23(32)4-2)15-21(28-24(17)30)29-12-6-5-10-20(29)11-13-31/h4,7-9,14-16,20,26,31H,2-3,5-6,10-13H2,1H3,(H,27,32)/t20-/m0/s1
Canonical SMILES
C=CC(=O)Nc1cccc(Nc2cc(N3CCCCC3CCO)nc3c(CC)cnn23)c1
Isomeric SMILES
CCC1=C2N=C(C=C(N2N=C1)NC3=CC(=CC=C3)NC(=O)C=C)N4CCCC[C@H]4CCO

Synonyms

  • (S)-N-(3-((3-Ethyl-5-(2-(2-hydroxyethyl)piperidin-1-yl)pyrazolo[1,5-a]pyrimidin-7-yl)amino)phenyl)acrylamide
  • N-[3-({3-ethyl-5-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]pyrazolo[1,5-a]pyrimidin-7-yl}amino)phenyl]prop-2-enamide
  • N-[3-[[3-ethyl-5-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]pyrazolo[1,5-a]pyrimidin-7-yl]amino]phenyl]prop-2-enamide
  • CDK12 inhibitor E9 R-isomer

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
434.54 g/molcalc.
Exact mass
434.243 Dacalc.
LogP (octanol/water)
3.9calc.
Topological polar surface area
94.79 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
6calc.
Rotatable bonds
8calc.
Heavy atoms
32calc.
Rings
4calc.
Aromatic rings
3calc.
Fraction sp3 carbons
0.38calc.
Formal charge
0calc.
Stereocentres
1calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, c1ccc(Nc2cc(N3CCCCC3)nc3ccnn23)cc1

c1ccc(Nc2cc(N3CCCCC3)nc3ccnn23)cc1

4 rings, 22 atoms.

1 other chemical share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Cdk12-IN-E9 suppliers

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Cdk12-IN-E9 price

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Uses and applications

What the substance is used for, by industry and function

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Cdk12-IN-E9 is traded under.

HS 2933.59Indicative HS code

Compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring, other

World exports in 2024
$18.4B
+10.5% vs 2023, imports $24.8B
2019 to 2024
Top exporters
  1. Ireland43.6%
  2. Switzerland * partner reported26.3%
  3. China7.9%
Top importers
  1. Slovenia30.3%
  2. United States30.1%
  3. Germany15.3%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Cdk12-IN-E9 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Cdk12-IN-E9, based on the data on this page

What is Cdk12-IN-E9?

Cdk12-IN-E9 is a chemical substance with the molecular formula C24H30N6O2 and a molar mass of 434.54 g/mol. Its CAS registry number is 2020052-55-3. The IUPAC name is N-[3-[[3-ethyl-5-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]pyrazolo[1,5-a]pyrimidin-7-yl]amino]phenyl]prop-2-enamide.

What is the CAS number of Cdk12-IN-E9?

The CAS registry number of Cdk12-IN-E9 is 2020052-55-3. Other or deprecated CAS numbers: 2020052-51-9.

What is the molecular formula and weight of Cdk12-IN-E9?

The molecular formula of Cdk12-IN-E9 is C24H30N6O2 and its molar mass is 434.54 g/mol.

What is Cdk12-IN-E9 used for?

Known uses and roles of Cdk12-IN-E9 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Cdk12-IN-E9 hazardous?

No GHS hazard classification for Cdk12-IN-E9 is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Cdk12-IN-E9?

Cdk12-IN-E9 is usually classified under HS code 293359 (Compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Cdk12-IN-E9?

CompoundList lists 1 supplier of Cdk12-IN-E9 in China. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Cdk12-IN-E9?

Suppliers quote Cdk12-IN-E9 on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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