Y040-2734 Screening compound: 2-[2-(4-oxo-3,4-dihydro-1,2,3-benzotriazin-3-yl)acetamido]acetic acid

Y040-2734 Screening compound: 2-[2-(4-oxo-3,4-dihydro-1,2,3-benzotriazin-3-yl)acetamido]acetic acid
Y040-2734 Screening compound: 2-[2-(4-oxo-3,4-dihydro-1,2,3-benzotriazin-3-yl)acetamido]acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-2734
2-[2-(4-oxo-3,4-dihydro-1,2,3-benzotriazin-3-yl)acetamido]acetic acid

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

Y040-2734

Molecular Formula

C11H10N4O4 (C11 H10 N4 O4)

Compound Name

2-[2-(4-oxo-3,4-dihydro-1,2,3-benzotriazin-3-yl)acetamido]acetic acid

IUPAC name

2-[2-(4-oxo-34-dihydro-123-benzotriazin-3-yl)acetamido]acetic acid

SMILES

OC(CNC(CN1N=Nc(cccc2)c2C1=O)=O)=O

InChI

InChI=1S/C11H10N4O4/c16-9(12-5-10(17)18)6-15-11(19)7-3-1-2-4-8(7)13-14-15/h1-4H,5-6H2,(H,12,16)(H,17,18)

InChI Key

PPZSRNLLHXLNCA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06608554

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

262.22

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

-0.581

Distribution Coefficient, logD

-4.510

Water Solubility, LogSw

-2.25

Polar Surface Area

94.060

Acid Dissociation Constant (pKa)

3.47

Base Dissociation Constant (pKb)

-1.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

Y040-2734 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y040-2734 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-2734?
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What is the minimum amount of Y040-2734 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-2734
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-2734
  • 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 Y040-2734 available by request