G022-0356 Screening compound: 2-(4-chlorophenyl)-8-(2,5-dimethoxybenzenesulfonyl)-3-(ethylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene

G022-0356 Screening compound: 2-(4-chlorophenyl)-8-(2,5-dimethoxybenzenesulfonyl)-3-(ethylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene
G022-0356 Screening compound: 2-(4-chlorophenyl)-8-(2,5-dimethoxybenzenesulfonyl)-3-(ethylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene alternative view

Chemical Structure Depiction of ChemDiv screening compound G022-0356
2-(4-chlorophenyl)-8-(2,5-dimethoxybenzenesulfonyl)-3-(ethylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene

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

G022-0356

Molecular Formula

C23H26ClN3O4S2 (C23 H26 ClN3 O4 S2)

Compound Name

2-(4-chlorophenyl)-8-(2,5-dimethoxybenzenesulfonyl)-3-(ethylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene

IUPAC name

2-(4-chlorophenyl)-8-(25-dimethoxybenzenesulfonyl)-3-(ethylsulfanyl)-148-triazaspiro[4.5]deca-13-diene

SMILES

CCSC1=NC(CC2)(CCN2S(c(cc(cc2)OC)c2OC)(=O)=O)N=C1c(cc1)ccc1Cl

InChI

InChI=1S/C23H26ClN3O4S2/c1-4-32-22-21(16-5-7-17(24)8-6-16)25-23(26-22)11-13-27(14-12-23)33(28,29)20-15-18(30-2)9-10-19(20)31-3/h5-10,15H,4,11-14H2,1-3H3

InChI Key

MPAYPUUMJMGIHL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14977784

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

508.06

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.350

Distribution Coefficient, logD

4.350

Water Solubility, LogSw

-4.65

Polar Surface Area

64.045

Acid Dissociation Constant (pKa)

27.88

Base Dissociation Constant (pKb)

-2.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

G022-0356 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

Spiro Library (21655 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
  • Cyclic compounds

References: we are preparing a list of scientific research reports with G022-0356 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G022-0356?
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What is the minimum amount of G022-0356 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G022-0356
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G022-0356
  • 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 G022-0356 available by request