C224-4843 Screening compound: N-(4-bromo-3-methylphenyl)-4-[3-(thiophene-2-sulfonyl)propanamido]benzamide

C224-4843 Screening compound: N-(4-bromo-3-methylphenyl)-4-[3-(thiophene-2-sulfonyl)propanamido]benzamide
C224-4843 Screening compound: N-(4-bromo-3-methylphenyl)-4-[3-(thiophene-2-sulfonyl)propanamido]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C224-4843
N-(4-bromo-3-methylphenyl)-4-[3-(thiophene-2-sulfonyl)propanamido]benzamide

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

C224-4843

Molecular Formula

C21H19BrN2O4S2 (C21 H19 BrN2 O4 S2)

Compound Name

N-(4-bromo-3-methylphenyl)-4-[3-(thiophene-2-sulfonyl)propanamido]benzamide

IUPAC name

N-(4-bromo-3-methylphenyl)-4-[3-(thiophene-2-sulfonyl)propanamido]benzamide

SMILES

Cc(cc(cc1)NC(c(cc2)ccc2NC(CCS(c2cccs2)(=O)=O)=O)=O)c1Br

InChI

InChI=1S/C21H19BrN2O4S2/c1-14-13-17(8-9-18(14)22)24-21(26)15-4-6-16(7-5-15)23-19(25)10-12-30(27,28)20-3-2-11-29-20/h2-9,11,13H,10,12H2,1H3,(H,23,25)(H,24,26)

InChI Key

SWPVYQPSLCSOGC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14732819

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

507.43

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.011

Distribution Coefficient, logD

4.007

Water Solubility, LogSw

-4.15

Polar Surface Area

76.262

Acid Dissociation Constant (pKa)

9.39

Base Dissociation Constant (pKb)

-1.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

C224-4843 in Drug Discovery

Included in Screening Libraries

CNS targets activity set (6557 compounds)

Human Kinases Annotated Library (2415 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C224-4843 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C224-4843?
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What is the minimum amount of C224-4843 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C224-4843
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C224-4843
  • 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 C224-4843 available by request