C224-4302 Screening compound: 3-[(5-bromothiophen-2-yl)sulfonyl]-N-[4-(propan-2-yl)phenyl]propanamide

C224-4302 Screening compound: 3-[(5-bromothiophen-2-yl)sulfonyl]-N-[4-(propan-2-yl)phenyl]propanamide
C224-4302 Screening compound: 3-[(5-bromothiophen-2-yl)sulfonyl]-N-[4-(propan-2-yl)phenyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C224-4302
3-[(5-bromothiophen-2-yl)sulfonyl]-N-[4-(propan-2-yl)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

C224-4302

Molecular Formula

C16H18BrNO3S2 (C16 H18 BrNO3 S2)

Compound Name

3-[(5-bromothiophen-2-yl)sulfonyl]-N-[4-(propan-2-yl)phenyl]propanamide

IUPAC name

3-[(5-bromothiophen-2-yl)sulfonyl]-N-[4-(propan-2-yl)phenyl]propanamide

SMILES

CC(C)c(cc1)ccc1NC(CCS(c(s1)ccc1Br)(=O)=O)=O

InChI

InChI=1S/C16H18BrNO3S2/c1-11(2)12-3-5-13(6-4-12)18-15(19)9-10-23(20,21)16-8-7-14(17)22-16/h3-8,11H,9-10H2,1-2H3,(H,18,19)

InChI Key

BKSVOSOIPDIWLF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14732791

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.36

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.298

Distribution Coefficient, logD

4.298

Water Solubility, LogSw

-4.19

Polar Surface Area

53.171

Acid Dissociation Constant (pKa)

12.12

Base Dissociation Constant (pKb)

-1.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

C224-4302 in Drug Discovery

Included in Screening Libraries

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 C224-4302 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C224-4302?
Check Price and Availability of C224-4302, 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 C224-4302 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C224-4302
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C224-4302
  • 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 C224-4302 available by request