C224-4876 Screening compound: N-(3-methoxyphenyl)-4-[3-(thiophene-2-sulfonyl)propanamido]benzamide

C224-4876 Screening compound: N-(3-methoxyphenyl)-4-[3-(thiophene-2-sulfonyl)propanamido]benzamide
C224-4876 Screening compound: N-(3-methoxyphenyl)-4-[3-(thiophene-2-sulfonyl)propanamido]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C224-4876
N-(3-methoxyphenyl)-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

C224-4876

Molecular Formula

C21H20N2O5S2 (C21 H20 N2 O5 S2)

Compound Name

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

IUPAC name

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

SMILES

COc1cccc(NC(c(cc2)ccc2NC(CCS(c2cccs2)(=O)=O)=O)=O)c1

InChI

InChI=1S/C21H20N2O5S2/c1-28-18-5-2-4-17(14-18)23-21(25)15-7-9-16(10-8-15)22-19(24)11-13-30(26,27)20-6-3-12-29-20/h2-10,12,14H,11,13H2,1H3,(H,22,24)(H,23,25)

InChI Key

RWKVCYUJGSOQPB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14732824

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.53

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.903

Distribution Coefficient, logD

2.902

Water Solubility, LogSw

-3.71

Polar Surface Area

83.806

Acid Dissociation Constant (pKa)

10.03

Base Dissociation Constant (pKb)

-1.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

C224-4876 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with C224-4876 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C224-4876?
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What is the minimum amount of C224-4876 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C224-4876
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C224-4876
  • 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 C224-4876 available by request