C521-0357 Screening compound: 5-[(4-bromobenzenesulfonyl)methyl]-N-{3-[ethyl(3-methylphenyl)amino]propyl}furan-2-carboxamide

C521-0357 Screening compound: 5-[(4-bromobenzenesulfonyl)methyl]-N-{3-[ethyl(3-methylphenyl)amino]propyl}furan-2-carboxamide
C521-0357 Screening compound: 5-[(4-bromobenzenesulfonyl)methyl]-N-{3-[ethyl(3-methylphenyl)amino]propyl}furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C521-0357
5-[(4-bromobenzenesulfonyl)methyl]-N-{3-[ethyl(3-methylphenyl)amino]propyl}furan-2-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

C521-0357

Molecular Formula

C24H27BrN2O4S (C24 H27 BrN2 O4 S)

Compound Name

5-[(4-bromobenzenesulfonyl)methyl]-N-{3-[ethyl(3-methylphenyl)amino]propyl}furan-2-carboxamide

IUPAC name

5-[(4-bromobenzenesulfonyl)methyl]-N-{3-[ethyl(3-methylphenyl)amino]propyl}furan-2-carboxamide

SMILES

CCN(CCCNC(c1ccc(CS(c(cc2)ccc2Br)(=O)=O)o1)=O)c1cc(C)ccc1

InChI

InChI=1S/C24H27BrN2O4S/c1-3-27(20-7-4-6-18(2)16-20)15-5-14-26-24(28)23-13-10-21(31-23)17-32(29,30)22-11-8-19(25)9-12-22/h4,6-13,16H,3,5,14-15,17H2,1-2H3,(H,26,28)

InChI Key

IHXRSYFQTNELCB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14765345

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

519.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.972

Distribution Coefficient, logD

4.944

Water Solubility, LogSw

-4.63

Polar Surface Area

64.089

Acid Dissociation Constant (pKa)

14.27

Base Dissociation Constant (pKb)

6.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

C521-0357 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C521-0357 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C521-0357?
Check Price and Availability of C521-0357, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C521-0357 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C521-0357
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C521-0357
  • 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 C521-0357 available by request