G022-0191 Screening compound: 8-(2,4-dimethylbenzenesulfonyl)-2-(ethylsulfanyl)-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene

G022-0191 Screening compound: 8-(2,4-dimethylbenzenesulfonyl)-2-(ethylsulfanyl)-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene
G022-0191 Screening compound: 8-(2,4-dimethylbenzenesulfonyl)-2-(ethylsulfanyl)-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene alternative view

Chemical Structure Depiction of ChemDiv screening compound G022-0191
8-(2,4-dimethylbenzenesulfonyl)-2-(ethylsulfanyl)-3-phenyl-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

G022-0191

Molecular Formula

C23H27N3O2S2 (C23 H27 N3 O2 S2)

Compound Name

8-(2,4-dimethylbenzenesulfonyl)-2-(ethylsulfanyl)-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene

IUPAC name

8-(24-dimethylbenzenesulfonyl)-2-(ethylsulfanyl)-3-phenyl-148-triazaspiro[4.5]deca-13-diene

SMILES

CCSC1=NC(CC2)(CCN2S(c2c(C)cc(C)cc2)(=O)=O)N=C1c1ccccc1

InChI

InChI=1S/C23H27N3O2S2/c1-4-29-22-21(19-8-6-5-7-9-19)24-23(25-22)12-14-26(15-13-23)30(27,28)20-11-10-17(2)16-18(20)3/h5-11,16H,4,12-15H2,1-3H3

InChI Key

XSAOCNXQWHAEGB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14977731

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

441.62

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.672

Distribution Coefficient, logD

4.672

Water Solubility, LogSw

-4.34

Polar Surface Area

48.871

Acid Dissociation Constant (pKa)

27.12

Base Dissociation Constant (pKb)

-2.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

References: we are preparing a list of scientific research reports with G022-0191 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G022-0191?
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What is the minimum amount of G022-0191 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G022-0191
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G022-0191
  • 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 G022-0191 available by request