S322-0184 Screening compound: 1-(benzenesulfonyl)-3-[4-(2,5-dimethoxyphenyl)-5-(propylsulfanyl)-4H-1,2,4-triazol-3-yl]-1H-indole

S322-0184 Screening compound: 1-(benzenesulfonyl)-3-[4-(2,5-dimethoxyphenyl)-5-(propylsulfanyl)-4H-1,2,4-triazol-3-yl]-1H-indole
S322-0184 Screening compound: 1-(benzenesulfonyl)-3-[4-(2,5-dimethoxyphenyl)-5-(propylsulfanyl)-4H-1,2,4-triazol-3-yl]-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound S322-0184
1-(benzenesulfonyl)-3-[4-(2,5-dimethoxyphenyl)-5-(propylsulfanyl)-4H-1,2,4-triazol-3-yl]-1H-indole

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

S322-0184

Molecular Formula

C27H26N4O4S2 (C27 H26 N4 O4 S2)

Compound Name

1-(benzenesulfonyl)-3-[4-(2,5-dimethoxyphenyl)-5-(propylsulfanyl)-4H-1,2,4-triazol-3-yl]-1H-indole

IUPAC name

1-(benzenesulfonyl)-3-[4-(25-dimethoxyphenyl)-5-(propylsulfanyl)-4H-124-triazol-3-yl]-1H-indole

SMILES

CCCSc1nnc(-c(c2c3cccc2)cn3S(c2ccccc2)(=O)=O)n1-c(cc(cc1)OC)c1OC

InChI

InChI=1S/C27H26N4O4S2/c1-4-16-36-27-29-28-26(31(27)24-17-19(34-2)14-15-25(24)35-3)22-18-30(23-13-9-8-12-21(22)23)37(32,33)20-10-6-5-7-11-20/h5-15,17-18H,4,16H2,1-3H3

InChI Key

MPYXWNSLKGSIJU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27618085

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

534.66

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.564

Distribution Coefficient, logD

5.564

Water Solubility, LogSw

-5.69

Polar Surface Area

68.850

Acid Dissociation Constant (pKa)

26.40

Base Dissociation Constant (pKb)

1.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.50

References: we are preparing a list of scientific research reports with S322-0184 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S322-0184?
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What is the minimum amount of S322-0184 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S322-0184
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S322-0184
  • 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 S322-0184 available by request