S322-0159 Screening compound: 1-(benzenesulfonyl)-3-{5-[(diphenylmethyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}-1H-indole

S322-0159 Screening compound: 1-(benzenesulfonyl)-3-{5-[(diphenylmethyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}-1H-indole
S322-0159 Screening compound: 1-(benzenesulfonyl)-3-{5-[(diphenylmethyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound S322-0159
1-(benzenesulfonyl)-3-{5-[(diphenylmethyl)sulfanyl]-4-methyl-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

S322-0159

Molecular Formula

C30H24N4O2S2 (C30 H24 N4 O2 S2)

Compound Name

1-(benzenesulfonyl)-3-{5-[(diphenylmethyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}-1H-indole

IUPAC name

1-(benzenesulfonyl)-3-{5-[(diphenylmethyl)sulfanyl]-4-methyl-4H-124-triazol-3-yl}-1H-indole

SMILES

Cn1c(SC(c2ccccc2)c2ccccc2)nnc1-c(c1c2cccc1)cn2S(c1ccccc1)(=O)=O

InChI

InChI=1S/C30H24N4O2S2/c1-33-29(31-32-30(33)37-28(22-13-5-2-6-14-22)23-15-7-3-8-16-23)26-21-34(27-20-12-11-19-25(26)27)38(35,36)24-17-9-4-10-18-24/h2-21,28H,1H3

InChI Key

QQGFTNCBBSTYJT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27618066

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

536.68

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.646

Distribution Coefficient, logD

6.646

Water Solubility, LogSw

-6.09

Polar Surface Area

53.772

Acid Dissociation Constant (pKa)

20.52

Base Dissociation Constant (pKb)

1.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

S322-0159 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with S322-0159 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S322-0159?
Check Price and Availability of S322-0159, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of S322-0159 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S322-0159
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S322-0159
  • 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 S322-0159 available by request