Y020-8012 Screening compound: ethyl 4-methyl-2-{[3-(trifluoromethyl)phenyl]amino}pyrimidine-5-carboxylate

Y020-8012 Screening compound: ethyl 4-methyl-2-{[3-(trifluoromethyl)phenyl]amino}pyrimidine-5-carboxylate
Y020-8012 Screening compound: ethyl 4-methyl-2-{[3-(trifluoromethyl)phenyl]amino}pyrimidine-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-8012
ethyl 4-methyl-2-{[3-(trifluoromethyl)phenyl]amino}pyrimidine-5-carboxylate

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

Y020-8012

Molecular Formula

C15H14F3N3O2 (C15 H14 F3 N3 O2)

Compound Name

ethyl 4-methyl-2-{[3-(trifluoromethyl)phenyl]amino}pyrimidine-5-carboxylate

IUPAC name

ethyl 4-methyl-2-{[3-(trifluoromethyl)phenyl]amino}pyrimidine-5-carboxylate

SMILES

CCOC(c1c(C)nc(Nc2cccc(C(F)(F)F)c2)nc1)=O

InChI

InChI=1S/C15H14F3N3O2/c1-3-23-13(22)12-8-19-14(20-9(12)2)21-11-6-4-5-10(7-11)15(16,17)18/h4-8H,3H2,1-2H3,(H,19,20,21)

InChI Key

GAINXCFIEOHDMG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08131926

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

325.29

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.158

Distribution Coefficient, logD

4.158

Water Solubility, LogSw

-4.16

Polar Surface Area

50.708

Acid Dissociation Constant (pKa)

14.77

Base Dissociation Constant (pKb)

0.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

Y020-8012 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y020-8012 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-8012?
Check Price and Availability of Y020-8012, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of Y020-8012 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-8012
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-8012
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of Y020-8012 available by request