P196-0304 Screening compound: methyl 4-{2-[4,5-dimethyl-6-oxo-2-(pyrazin-2-yl)-1,6-dihydropyrimidin-1-yl]acetamido}benzoate

P196-0304 Screening compound: methyl 4-{2-[4,5-dimethyl-6-oxo-2-(pyrazin-2-yl)-1,6-dihydropyrimidin-1-yl]acetamido}benzoate
P196-0304 Screening compound: methyl 4-{2-[4,5-dimethyl-6-oxo-2-(pyrazin-2-yl)-1,6-dihydropyrimidin-1-yl]acetamido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound P196-0304
methyl 4-{2-[4,5-dimethyl-6-oxo-2-(pyrazin-2-yl)-1,6-dihydropyrimidin-1-yl]acetamido}benzoate

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

P196-0304

Molecular Formula

C20H19N5O4 (C20 H19 N5 O4)

Compound Name

methyl 4-{2-[4,5-dimethyl-6-oxo-2-(pyrazin-2-yl)-1,6-dihydropyrimidin-1-yl]acetamido}benzoate

IUPAC name

methyl 4-{2-[45-dimethyl-6-oxo-2-(pyrazin-2-yl)-16-dihydropyrimidin-1-yl]acetamido}benzoate

SMILES

CC1=C(C)N=C(c2nccnc2)N(CC(Nc(cc2)ccc2C(OC)=O)=O)C1=O

InChI

InChI=1S/C20H19N5O4/c1-12-13(2)23-18(16-10-21-8-9-22-16)25(19(12)27)11-17(26)24-15-6-4-14(5-7-15)20(28)29-3/h4-10H,11H2,1-3H3,(H,24,26)

InChI Key

GFHWIWXGCQCYEN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29011621

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.4

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.315

Distribution Coefficient, logD

1.315

Water Solubility, LogSw

-1.64

Polar Surface Area

87.890

Acid Dissociation Constant (pKa)

11.22

Base Dissociation Constant (pKb)

2.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

P196-0304 in Drug Discovery

Included in Screening Libraries

Bcl2-PPI Inhibitors Library (12246 compounds)

Bromodomain Modulators Library (5801 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with P196-0304 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P196-0304?
Check Price and Availability of P196-0304, 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 P196-0304 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P196-0304
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P196-0304
  • 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 P196-0304 available by request