D298-0402 Screening compound: 2-{[(2,3-dimethoxyphenyl)methyl]amino}-5,6-dimethyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

D298-0402 Screening compound: 2-{[(2,3-dimethoxyphenyl)methyl]amino}-5,6-dimethyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
D298-0402 Screening compound: 2-{[(2,3-dimethoxyphenyl)methyl]amino}-5,6-dimethyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D298-0402
2-{[(2,3-dimethoxyphenyl)methyl]amino}-5,6-dimethyl-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

D298-0402

Molecular Formula

C16H19N5O3 (C16 H19 N5 O3)

Compound Name

2-{[(2,3-dimethoxyphenyl)methyl]amino}-5,6-dimethyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

IUPAC name

2-{[(23-dimethoxyphenyl)methyl]amino}-56-dimethyl-4H7H-[124]triazolo[15-a]pyrimidin-7-one

SMILES

CC1=C(C)Nc2nc(NCc(cccc3OC)c3OC)nn2C1=O

InChI

InChI=1S/C16H19N5O3/c1-9-10(2)18-16-19-15(20-21(16)14(9)22)17-8-11-6-5-7-12(23-3)13(11)24-4/h5-7H,8H2,1-4H3,(H2,17,18,19,20)

InChI Key

PZTOYUGLSNCMGG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14817298

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.36

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.970

Distribution Coefficient, logD

1.877

Water Solubility, LogSw

-2.43

Polar Surface Area

77.239

Acid Dissociation Constant (pKa)

8.03

Base Dissociation Constant (pKb)

-1.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

References: we are preparing a list of scientific research reports with D298-0402 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D298-0402?
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What is the minimum amount of D298-0402 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D298-0402
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D298-0402
  • 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 D298-0402 available by request