G227-0045 Screening compound: 4-(2H-1,3-benzodioxol-5-yl)-2-[4-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1,3-thiazole

G227-0045 Screening compound: 4-(2H-1,3-benzodioxol-5-yl)-2-[4-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1,3-thiazole
G227-0045 Screening compound: 4-(2H-1,3-benzodioxol-5-yl)-2-[4-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1,3-thiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound G227-0045
4-(2H-1,3-benzodioxol-5-yl)-2-[4-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1,3-thiazole

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

G227-0045

Molecular Formula

C20H12N2O4S2 (C20 H12 N2 O4 S2)

Compound Name

4-(2H-1,3-benzodioxol-5-yl)-2-[4-(2H-1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1,3-thiazole

IUPAC name

4-(2H-13-benzodioxol-5-yl)-2-[4-(2H-13-benzodioxol-5-yl)-13-thiazol-2-yl]-13-thiazole

SMILES

C1Oc(cc(cc2)-c3csc(-c4nc(-c(cc5)cc6c5OCO6)cs4)n3)c2O1

InChI

InChI=1S/C20H12N2O4S2/c1-3-15-17(25-9-23-15)5-11(1)13-7-27-19(21-13)20-22-14(8-28-20)12-2-4-16-18(6-12)26-10-24-16/h1-8H,9-10H2

InChI Key

WDFORNZCIOTLNB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01082969

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.101

Distribution Coefficient, logD

6.101

Water Solubility, LogSw

-6.22

Polar Surface Area

53.666

Acid Dissociation Constant (pKa)

37.89

Base Dissociation Constant (pKb)

-0.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

G227-0045 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with G227-0045 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G227-0045?
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What is the minimum amount of G227-0045 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G227-0045
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G227-0045
  • 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 G227-0045 available by request