D433-1337 Screening compound: 5,6-dimethyl-2-{[(2-methylphenyl)amino]methyl}-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

D433-1337 Screening compound: 5,6-dimethyl-2-{[(2-methylphenyl)amino]methyl}-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
D433-1337 Screening compound: 5,6-dimethyl-2-{[(2-methylphenyl)amino]methyl}-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D433-1337
5,6-dimethyl-2-{[(2-methylphenyl)amino]methyl}-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

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

D433-1337

Molecular Formula

C15H17N5O (C15 H17 N5 O)

Compound Name

5,6-dimethyl-2-{[(2-methylphenyl)amino]methyl}-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

IUPAC name

56-dimethyl-2-{[(2-methylphenyl)amino]methyl}-4H7H-[124]triazolo[15-a]pyrimidin-7-one

SMILES

Cc(cccc1)c1NCc(nc1NC(C)=C2C)nn1C2=O

InChI

InChI=1S/C15H17N5O/c1-9-6-4-5-7-12(9)16-8-13-18-15-17-11(3)10(2)14(21)20(15)19-13/h4-7,16H,8H2,1-3H3,(H,17,18,19)

InChI Key

KWNNDIQNCLLKHP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27586074

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

283.33

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.985

Distribution Coefficient, logD

-0.049

Water Solubility, LogSw

-2.23

Polar Surface Area

61.050

Acid Dissociation Constant (pKa)

5.37

Base Dissociation Constant (pKb)

-0.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

D433-1337 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 D433-1337 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D433-1337?
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What is the minimum amount of D433-1337 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D433-1337
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D433-1337
  • 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 D433-1337 available by request