S322-0308 Screening compound: 2-({5-[1-(benzenesulfonyl)-1H-indol-3-yl]-4-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-chlorophenyl)acetamide

S322-0308 Screening compound: 2-({5-[1-(benzenesulfonyl)-1H-indol-3-yl]-4-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-chlorophenyl)acetamide
S322-0308 Screening compound: 2-({5-[1-(benzenesulfonyl)-1H-indol-3-yl]-4-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-chlorophenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S322-0308
2-({5-[1-(benzenesulfonyl)-1H-indol-3-yl]-4-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-chlorophenyl)acetamide

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

S322-0308

Molecular Formula

C31H24ClN5O4S2 (C31 H24 ClN5 O4 S2)

Compound Name

2-({5-[1-(benzenesulfonyl)-1H-indol-3-yl]-4-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-chlorophenyl)acetamide

IUPAC name

2-({5-[1-(benzenesulfonyl)-1H-indol-3-yl]-4-(3-methoxyphenyl)-4H-124-triazol-3-yl}sulfanyl)-N-(3-chlorophenyl)acetamide

SMILES

COc1cccc(-n2c(SCC(Nc3cccc(Cl)c3)=O)nnc2-c(c2c3cccc2)cn3S(c2ccccc2)(=O)=O)c1

InChI

InChI=1S/C31H24ClN5O4S2/c1-41-24-12-8-11-23(18-24)37-30(34-35-31(37)42-20-29(38)33-22-10-7-9-21(32)17-22)27-19-36(28-16-6-5-15-26(27)28)43(39,40)25-13-3-2-4-14-25/h2-19H,20H2,1H3,(H,33,38)

InChI Key

IHLYUXFJLLVMBT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27618194

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

630.15

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

6.509

Distribution Coefficient, logD

6.509

Water Solubility, LogSw

-6.24

Polar Surface Area

84.399

Acid Dissociation Constant (pKa)

11.01

Base Dissociation Constant (pKb)

-0.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.50

References: we are preparing a list of scientific research reports with S322-0308 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S322-0308?
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What is the minimum amount of S322-0308 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S322-0308
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S322-0308
  • 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 S322-0308 available by request