G022-0097 Screening compound: 2-(4-chlorophenyl)-3-(methylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-dien-8-yl phenyl sulfone

G022-0097 Screening compound: 2-(4-chlorophenyl)-3-(methylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-dien-8-yl phenyl sulfone
G022-0097 Screening compound: 2-(4-chlorophenyl)-3-(methylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-dien-8-yl phenyl sulfone alternative view

Chemical Structure Depiction of ChemDiv screening compound G022-0097
2-(4-chlorophenyl)-3-(methylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-dien-8-yl phenyl sulfone

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

G022-0097

Molecular Formula

C20H20ClN3O2S2 (C20 H20 ClN3 O2 S2)

Compound Name

2-(4-chlorophenyl)-3-(methylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-dien-8-yl phenyl sulfone

IUPAC name

8-(benzenesulfonyl)-2-(4-chlorophenyl)-3-(methylsulfanyl)-148-triazaspiro[4.5]deca-13-diene

SMILES

CSC1=NC(CC2)(CCN2S(c2ccccc2)(=O)=O)N=C1c(cc1)ccc1Cl

InChI

InChI=1S/C20H20ClN3O2S2/c1-27-19-18(15-7-9-16(21)10-8-15)22-20(23-19)11-13-24(14-12-20)28(25,26)17-5-3-2-4-6-17/h2-10H,11-14H2,1H3

InChI Key

ZNDNCDMLLCBVPC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14977712

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.98

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.907

Distribution Coefficient, logD

3.907

Water Solubility, LogSw

-4.46

Polar Surface Area

48.871

Acid Dissociation Constant (pKa)

27.88

Base Dissociation Constant (pKb)

-2.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

References: we are preparing a list of scientific research reports with G022-0097 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G022-0097?
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What is the minimum amount of G022-0097 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G022-0097
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G022-0097
  • 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 G022-0097 available by request