C224-4297 Screening compound: 3-[(5-bromothien-2-yl)sulfonyl]-N-(3-methoxybenzyl)propanamide

C224-4297 Screening compound: 3-[(5-bromothien-2-yl)sulfonyl]-N-(3-methoxybenzyl)propanamide
C224-4297 Screening compound: 3-[(5-bromothien-2-yl)sulfonyl]-N-(3-methoxybenzyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C224-4297
3-[(5-bromothien-2-yl)sulfonyl]-N-(3-methoxybenzyl)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

C224-4297

Molecular Formula

C15H16BrNO4S2 (C15 H16 BrNO4 S2)

Compound Name

3-[(5-bromothien-2-yl)sulfonyl]-N-(3-methoxybenzyl)propanamide

IUPAC name

3-[(5-bromothiophen-2-yl)sulfonyl]-N-[(3-methoxyphenyl)methyl]propanamide

SMILES

COc1cccc(CNC(CCS(c(s2)ccc2Br)(=O)=O)=O)c1

InChI

InChI=1S/C15H16BrNO4S2/c1-21-12-4-2-3-11(9-12)10-17-14(18)7-8-23(19,20)15-6-5-13(16)22-15/h2-6,9H,7-8,10H2,1H3,(H,17,18)

InChI Key

NNGYUCYOKMOJAX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14732789

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.33

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.757

Distribution Coefficient, logD

2.757

Water Solubility, LogSw

-3.35

Polar Surface Area

62.037

Acid Dissociation Constant (pKa)

13.23

Base Dissociation Constant (pKb)

-2.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

C224-4297 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 C224-4297 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C224-4297?
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What is the minimum amount of C224-4297 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C224-4297
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C224-4297
  • 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 C224-4297 available by request