Y041-8223 Screening compound: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-phenyl-N-[2-(pyridin-4-yl)ethyl]propanamide

Y041-8223 Screening compound: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-phenyl-N-[2-(pyridin-4-yl)ethyl]propanamide
Y041-8223 Screening compound: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-phenyl-N-[2-(pyridin-4-yl)ethyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-8223
2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-phenyl-N-[2-(pyridin-4-yl)ethyl]propanamide

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

Y041-8223

Molecular Formula

C22H25N5O (C22 H25 N5 O)

Compound Name

2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-phenyl-N-[2-(pyridin-4-yl)ethyl]propanamide

IUPAC name

2-[(46-dimethylpyrimidin-2-yl)amino]-3-phenyl-N-[2-(pyridin-4-yl)ethyl]propanamide

SMILES

Cc1nc(NC(Cc2ccccc2)C(NCCc2ccncc2)=O)nc(C)c1

InChI

InChI=1S/C22H25N5O/c1-16-14-17(2)26-22(25-16)27-20(15-19-6-4-3-5-7-19)21(28)24-13-10-18-8-11-23-12-9-18/h3-9,11-12,14,20H,10,13,15H2,1-2H3,(H,24,28)(H,25,26,27)/t20-/m0/s1

InChI Key

GFGJOTVYQZRVEJ-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD28368469

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.779

Distribution Coefficient, logD

1.733

Water Solubility, LogSw

-1.82

Polar Surface Area

63.105

Acid Dissociation Constant (pKa)

10.33

Base Dissociation Constant (pKb)

6.44

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.27

Y041-8223 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with Y041-8223 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-8223?
Check Price and Availability of Y041-8223, 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 Y041-8223 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-8223
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-8223
  • 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 Y041-8223 available by request