C607-0976 Screening compound: N'-benzyl-N-(4-fluorobenzenesulfonyl)guanidine

C607-0976 Screening compound: N'-benzyl-N-(4-fluorobenzenesulfonyl)guanidine
C607-0976 Screening compound: N'-benzyl-N-(4-fluorobenzenesulfonyl)guanidine alternative view

Chemical Structure Depiction of ChemDiv screening compound C607-0976
N'-benzyl-N-(4-fluorobenzenesulfonyl)guanidine

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

C607-0976

Molecular Formula

C14H14FN3O2S (C14 H14 FN3 O2 S)

Compound Name

N'-benzyl-N-(4-fluorobenzenesulfonyl)guanidine

IUPAC name

N'-benzyl-N-(4-fluorobenzenesulfonyl)guanidine

SMILES

N=C(NCc1ccccc1)NS(c(cc1)ccc1F)(=O)=O

InChI

InChI=1S/C14H14FN3O2S/c15-12-6-8-13(9-7-12)21(19,20)18-14(16)17-10-11-4-2-1-3-5-11/h1-9H,10H2,(H3,16,17,18)

InChI Key

AHSPESPSLSFTPS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14775420

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

307.35

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.816

Distribution Coefficient, logD

1.816

Water Solubility, LogSw

-2.54

Polar Surface Area

69.904

Acid Dissociation Constant (pKa)

8.31

Base Dissociation Constant (pKb)

6.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

C607-0976 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C607-0976 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C607-0976?
Check Price and Availability of C607-0976, 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 C607-0976 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C607-0976
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C607-0976
  • 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 C607-0976 available by request