G421-0524 Screening compound: 6-[(4-bromophenyl)methyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-amine

G421-0524 Screening compound: 6-[(4-bromophenyl)methyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-amine
G421-0524 Screening compound: 6-[(4-bromophenyl)methyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound G421-0524
6-[(4-bromophenyl)methyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-amine

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

G421-0524

Molecular Formula

C22H21BrN4O2 (C22 H21 BrN4 O2)

Compound Name

6-[(4-bromophenyl)methyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-amine

IUPAC name

6-[(4-bromophenyl)methyl]-N-(23-dihydro-14-benzodioxin-6-yl)-5H6H7H8H-pyrido[43-d]pyrimidin-2-amine

SMILES

Brc1ccc(CN(CC2)Cc3c2nc(Nc(cc2)cc4c2OCCO4)nc3)cc1

InChI

InChI=1S/C22H21BrN4O2/c23-17-3-1-15(2-4-17)13-27-8-7-19-16(14-27)12-24-22(26-19)25-18-5-6-20-21(11-18)29-10-9-28-20/h1-6,11-12H,7-10,13-14H2,(H,24,25,26)

InChI Key

GPTNGLBNMQBFIO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15012220

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.556

Distribution Coefficient, logD

3.552

Water Solubility, LogSw

-3.49

Polar Surface Area

50.096

Acid Dissociation Constant (pKa)

17.00

Base Dissociation Constant (pKb)

5.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

G421-0524 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G421-0524 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G421-0524?
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What is the minimum amount of G421-0524 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G421-0524
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G421-0524
  • 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 G421-0524 available by request