S322-0297 Screening compound: 2-({5-[1-(benzenesulfonyl)-1H-indol-3-yl]-4-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-cyclopentylacetamide

S322-0297 Screening compound: 2-({5-[1-(benzenesulfonyl)-1H-indol-3-yl]-4-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-cyclopentylacetamide
S322-0297 Screening compound: 2-({5-[1-(benzenesulfonyl)-1H-indol-3-yl]-4-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-cyclopentylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S322-0297
2-({5-[1-(benzenesulfonyl)-1H-indol-3-yl]-4-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-cyclopentylacetamide

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

S322-0297

Molecular Formula

C30H29N5O4S2 (C30 H29 N5 O4 S2)

Compound Name

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

IUPAC name

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

SMILES

COc1cccc(-n2c(SCC(NC3CCCC3)=O)nnc2-c(c2c3cccc2)cn3S(c2ccccc2)(=O)=O)c1

InChI

InChI=1S/C30H29N5O4S2/c1-39-23-13-9-12-22(18-23)35-29(32-33-30(35)40-20-28(36)31-21-10-5-6-11-21)26-19-34(27-17-8-7-16-25(26)27)41(37,38)24-14-3-2-4-15-24/h2-4,7-9,12-19,21H,5-6,10-11,20H2,1H3,(H,31,36)

InChI Key

FBWFQCJHYQWXRZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27618184

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

587.72

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

5.196

Distribution Coefficient, logD

5.196

Water Solubility, LogSw

-5.05

Polar Surface Area

85.812

Acid Dissociation Constant (pKa)

16.51

Base Dissociation Constant (pKb)

5.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.30

References: we are preparing a list of scientific research reports with S322-0297 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S322-0297?
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What is the minimum amount of S322-0297 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S322-0297
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S322-0297
  • 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 S322-0297 available by request