S348-1920 Screening compound: 2-[5,6-dimethyl-3-(3-methylphenyl)-2,4-dioxo-1H,2H,3H,4H,5H-pyrrolo[3,2-d]pyrimidin-1-yl]-N-(2-ethyl-6-methylphenyl)acetamide

S348-1920 Screening compound: 2-[5,6-dimethyl-3-(3-methylphenyl)-2,4-dioxo-1H,2H,3H,4H,5H-pyrrolo[3,2-d]pyrimidin-1-yl]-N-(2-ethyl-6-methylphenyl)acetamide
S348-1920 Screening compound: 2-[5,6-dimethyl-3-(3-methylphenyl)-2,4-dioxo-1H,2H,3H,4H,5H-pyrrolo[3,2-d]pyrimidin-1-yl]-N-(2-ethyl-6-methylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S348-1920
2-[5,6-dimethyl-3-(3-methylphenyl)-2,4-dioxo-1H,2H,3H,4H,5H-pyrrolo[3,2-d]pyrimidin-1-yl]-N-(2-ethyl-6-methylphenyl)acetamide

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

S348-1920

Molecular Formula

C26H28N4O3 (C26 H28 N4 O3)

Compound Name

2-[5,6-dimethyl-3-(3-methylphenyl)-2,4-dioxo-1H,2H,3H,4H,5H-pyrrolo[3,2-d]pyrimidin-1-yl]-N-(2-ethyl-6-methylphenyl)acetamide

IUPAC name

2-[56-dimethyl-3-(3-methylphenyl)-24-dioxo-1H2H3H4H5H-pyrrolo[32-d]pyrimidin-1-yl]-N-(2-ethyl-6-methylphenyl)acetamide

SMILES

CCc(cccc1C)c1NC(CN(c1c(C(N2c3cc(C)ccc3)=O)n(C)c(C)c1)C2=O)=O

InChI

InChI=1S/C26H28N4O3/c1-6-19-11-8-10-17(3)23(19)27-22(31)15-29-21-14-18(4)28(5)24(21)25(32)30(26(29)33)20-12-7-9-16(2)13-20/h7-14H,6,15H2,1-5H3,(H,27,31)

InChI Key

CRIRLAVGQBVSSC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29000228

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.778

Distribution Coefficient, logD

3.778

Water Solubility, LogSw

-3.78

Polar Surface Area

55.053

Acid Dissociation Constant (pKa)

12.88

Base Dissociation Constant (pKb)

-0.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

S348-1920 in Drug Discovery

Included in Screening Libraries

Bcl2-PPI Inhibitors Library (12246 compounds)

Ligand-Gated Ion Channels Library (3887 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Nervous system
  • Eye
Mechanism of action:
  • PPI modulators
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with S348-1920 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S348-1920?
Check Price and Availability of S348-1920, 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 S348-1920 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S348-1920
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S348-1920
  • 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 S348-1920 available by request