G867-0211 Screening compound: 1-(2,4-dimethylbenzenesulfonyl)-4-[3-(4-ethoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazine

G867-0211 Screening compound: 1-(2,4-dimethylbenzenesulfonyl)-4-[3-(4-ethoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazine
G867-0211 Screening compound: 1-(2,4-dimethylbenzenesulfonyl)-4-[3-(4-ethoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound G867-0211
1-(2,4-dimethylbenzenesulfonyl)-4-[3-(4-ethoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazine

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

G867-0211

Molecular Formula

C24H27N7O3S (C24 H27 N7 O3 S)

Compound Name

1-(2,4-dimethylbenzenesulfonyl)-4-[3-(4-ethoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazine

IUPAC name

1-(24-dimethylbenzenesulfonyl)-4-[3-(4-ethoxyphenyl)-3H-[123]triazolo[45-d]pyrimidin-7-yl]piperazine

SMILES

CCOc(cc1)ccc1-n1nnc2c1ncnc2N(CC1)CCN1S(c1c(C)cc(C)cc1)(=O)=O

InChI

InChI=1S/C24H27N7O3S/c1-4-34-20-8-6-19(7-9-20)31-24-22(27-28-31)23(25-16-26-24)29-11-13-30(14-12-29)35(32,33)21-10-5-17(2)15-18(21)3/h5-10,15-16H,4,11-14H2,1-3H3

InChI Key

SOJCSONXJLXZTC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08344828

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

493.59

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

4.119

Distribution Coefficient, logD

4.119

Water Solubility, LogSw

-4.10

Polar Surface Area

89.268

Acid Dissociation Constant (pKa)

21.80

Base Dissociation Constant (pKb)

3.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

G867-0211 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with G867-0211 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G867-0211?
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What is the minimum amount of G867-0211 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G867-0211
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G867-0211
  • 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 G867-0211 available by request