C224-3163 Screening compound: 3-(5-bromothiophene-2-sulfonamido)-N-cycloheptylpropanamide

C224-3163 Screening compound: 3-(5-bromothiophene-2-sulfonamido)-N-cycloheptylpropanamide
C224-3163 Screening compound: 3-(5-bromothiophene-2-sulfonamido)-N-cycloheptylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C224-3163
3-(5-bromothiophene-2-sulfonamido)-N-cycloheptylpropanamide

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

C224-3163

Molecular Formula

C14H21BrN2O3S2 (C14 H21 BrN2 O3 S2)

Compound Name

3-(5-bromothiophene-2-sulfonamido)-N-cycloheptylpropanamide

IUPAC name

3-(5-bromothiophene-2-sulfonamido)-N-cycloheptylpropanamide

SMILES

O=C(CCNS(c(s1)ccc1Br)(=O)=O)NC1CCCCCC1

InChI

InChI=1S/C14H21BrN2O3S2/c15-12-7-8-14(21-12)22(19,20)16-10-9-13(18)17-11-5-3-1-2-4-6-11/h7-8,11,16H,1-6,9-10H2,(H,17,18)

InChI Key

URYFAECMOUROOI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05025600

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.533

Distribution Coefficient, logD

3.533

Water Solubility, LogSw

-3.69

Polar Surface Area

67.384

Acid Dissociation Constant (pKa)

10.80

Base Dissociation Constant (pKb)

4.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

64.30

C224-3163 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C224-3163 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C224-3163?
Check Price and Availability of C224-3163, 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 C224-3163 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C224-3163
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C224-3163
  • 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 C224-3163 available by request