C274-8426 Screening compound: 1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-(2,5-dimethoxyphenyl)piperidine-3-carboxamide

C274-8426 Screening compound: 1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-(2,5-dimethoxyphenyl)piperidine-3-carboxamide
C274-8426 Screening compound: 1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-(2,5-dimethoxyphenyl)piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C274-8426
1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-(2,5-dimethoxyphenyl)piperidine-3-carboxamide

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

C274-8426

Molecular Formula

C20H22N4O6S (C20 H22 N4 O6 S)

Compound Name

1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-(2,5-dimethoxyphenyl)piperidine-3-carboxamide

IUPAC name

1-(213-benzoxadiazole-4-sulfonyl)-N-(25-dimethoxyphenyl)piperidine-3-carboxamide

SMILES

COc(cc1)cc(NC(C(CCC2)CN2S(c2cccc3nonc23)(=O)=O)=O)c1OC

InChI

InChI=1S/C20H22N4O6S/c1-28-14-8-9-17(29-2)16(11-14)21-20(25)13-5-4-10-24(12-13)31(26,27)18-7-3-6-15-19(18)23-30-22-15/h3,6-9,11,13H,4-5,10,12H2,1-2H3,(H,21,25)/t13-/m0/s1

InChI Key

RSGPPZWBTZZTQW-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD14740516

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.48

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.588

Distribution Coefficient, logD

2.578

Water Solubility, LogSw

-3.17

Polar Surface Area

105.540

Acid Dissociation Constant (pKa)

9.03

Base Dissociation Constant (pKb)

0.60

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.00

C274-8426 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Human Kinases Annotated Library (2415 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C274-8426 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C274-8426?
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What is the minimum amount of C274-8426 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C274-8426
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C274-8426
  • 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 C274-8426 available by request