K978-0830 Screening compound: 3-(4-BROMOBENZENESULFONYL)-N-(4-FLUOROPHENYL)PROPANAMIDE

K978-0830 Screening compound: 3-(4-BROMOBENZENESULFONYL)-N-(4-FLUOROPHENYL)PROPANAMIDE
K978-0830 Screening compound: 3-(4-BROMOBENZENESULFONYL)-N-(4-FLUOROPHENYL)PROPANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound K978-0830
3-(4-BROMOBENZENESULFONYL)-N-(4-FLUOROPHENYL)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

K978-0830

Molecular Formula

C15H13BrFNO3S (C15 H13 BrFNO3 S)

Compound Name

3-(4-BROMOBENZENESULFONYL)-N-(4-FLUOROPHENYL)PROPANAMIDE

IUPAC name

3-(4-bromobenzenesulfonyl)-N-(4-fluorophenyl)propanamide

SMILES

O=C(CCS(c(cc1)ccc1Br)(=O)=O)Nc(cc1)ccc1F

InChI

InChI=1S/C15H13BrFNO3S/c16-11-1-7-14(8-2-11)22(20,21)10-9-15(19)18-13-5-3-12(17)4-6-13/h1-8H,9-10H2,(H,18,19)

InChI Key

VZAGSPDFYNTNKR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15115665

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.24

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.123

Distribution Coefficient, logD

3.122

Water Solubility, LogSw

-3.52

Polar Surface Area

52.152

Acid Dissociation Constant (pKa)

9.97

Base Dissociation Constant (pKb)

-1.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

K978-0830 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with K978-0830 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K978-0830?
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What is the minimum amount of K978-0830 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K978-0830
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K978-0830
  • 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 K978-0830 available by request