C224-4288 Screening compound: 3-[(5-bromothiophen-2-yl)sulfonyl]-N-[3-(methylsulfanyl)phenyl]propanamide

C224-4288 Screening compound: 3-[(5-bromothiophen-2-yl)sulfonyl]-N-[3-(methylsulfanyl)phenyl]propanamide
C224-4288 Screening compound: 3-[(5-bromothiophen-2-yl)sulfonyl]-N-[3-(methylsulfanyl)phenyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C224-4288
3-[(5-bromothiophen-2-yl)sulfonyl]-N-[3-(methylsulfanyl)phenyl]propanamide

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

C224-4288

Molecular Formula

C14H14BrNO3S3 (C14 H14 BrNO3 S3)

Compound Name

3-[(5-bromothiophen-2-yl)sulfonyl]-N-[3-(methylsulfanyl)phenyl]propanamide

IUPAC name

3-[(5-bromothiophen-2-yl)sulfonyl]-N-[3-(methylsulfanyl)phenyl]propanamide

SMILES

CSc1cccc(NC(CCS(c(s2)ccc2Br)(=O)=O)=O)c1

InChI

InChI=1S/C14H14BrNO3S3/c1-20-11-4-2-3-10(9-11)16-13(17)7-8-22(18,19)14-6-5-12(15)21-14/h2-6,9H,7-8H2,1H3,(H,16,17)

InChI Key

CXBVVZNWCLJIMG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14732786

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.421

Distribution Coefficient, logD

3.421

Water Solubility, LogSw

-3.77

Polar Surface Area

53.171

Acid Dissociation Constant (pKa)

12.06

Base Dissociation Constant (pKb)

-1.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

C224-4288 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C224-4288 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C224-4288?
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What is the minimum amount of C224-4288 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C224-4288
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C224-4288
  • 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 C224-4288 available by request