F430-0061 Screening compound: 4-chloro-N-[(E)-N'-(2-fluorophenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl]benzamide

F430-0061 Screening compound: 4-chloro-N-[(E)-N'-(2-fluorophenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl]benzamide
F430-0061 Screening compound: 4-chloro-N-[(E)-N'-(2-fluorophenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F430-0061
4-chloro-N-[(E)-N'-(2-fluorophenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl]benzamide

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

F430-0061

Molecular Formula

C20H16ClFN4O (C20 H16 ClFN4 O)

Compound Name

4-chloro-N-[(E)-N'-(2-fluorophenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl]benzamide

IUPAC name

4-chloro-N-[(E)-N'-(2-fluorophenyl)-N-[(pyridin-4-yl)methyl]carbamimidoyl]benzamide

SMILES

O=C(c(cc1)ccc1Cl)N/C(/NCc1ccncc1)=N/c(cccc1)c1F

InChI

InChI=1S/C20H16ClFN4O/c21-16-7-5-15(6-8-16)19(27)26-20(24-13-14-9-11-23-12-10-14)25-18-4-2-1-3-17(18)22/h1-12H,13H2,(H2,24,25,26,27)

InChI Key

KKIVYOZCPJQDMF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27127667

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.82

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.124

Distribution Coefficient, logD

2.798

Water Solubility, LogSw

-3.73

Polar Surface Area

50.582

Acid Dissociation Constant (pKa)

9.14

Base Dissociation Constant (pKb)

7.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

F430-0061 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with F430-0061 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F430-0061?
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What is the minimum amount of F430-0061 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F430-0061
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F430-0061
  • 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 F430-0061 available by request