G284-0533 Screening compound: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]acetamide

G284-0533 Screening compound: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]acetamide
G284-0533 Screening compound: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G284-0533
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]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

G284-0533

Molecular Formula

C24H25N5O3 (C24 H25 N5 O3)

Compound Name

N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-[4,6-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl]acetamide

IUPAC name

N-[1-(23-dihydro-14-benzodioxin-6-yl)ethyl]-2-[46-dimethyl-3-(1H-pyrrol-1-yl)-1H-pyrazolo[34-b]pyridin-1-yl]acetamide

SMILES

CC(c(cc1)cc2c1OCCO2)NC(Cn(c1nc(C)cc(C)c11)nc1-n1cccc1)=O

InChI

InChI=1S/C24H25N5O3/c1-15-12-16(2)25-23-22(15)24(28-8-4-5-9-28)27-29(23)14-21(30)26-17(3)18-6-7-19-20(13-18)32-11-10-31-19/h4-9,12-13,17H,10-11,14H2,1-3H3,(H,26,30)/t17-/m0/s1

InChI Key

WDXXRQIQWGSZIE-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD14994705

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.844

Distribution Coefficient, logD

2.837

Water Solubility, LogSw

-3.19

Polar Surface Area

66.104

Acid Dissociation Constant (pKa)

14.55

Base Dissociation Constant (pKb)

5.59

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.20

G284-0533 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with G284-0533 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G284-0533?
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What is the minimum amount of G284-0533 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G284-0533
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G284-0533
  • 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 G284-0533 available by request