F036-0963 Screening compound: 4-fluoro-N-[(E)-N-[2-(1H-indol-3-yl)ethyl]-N'-phenylcarbamimidoyl]benzamide

F036-0963 Screening compound: 4-fluoro-N-[(E)-N-[2-(1H-indol-3-yl)ethyl]-N'-phenylcarbamimidoyl]benzamide
F036-0963 Screening compound: 4-fluoro-N-[(E)-N-[2-(1H-indol-3-yl)ethyl]-N'-phenylcarbamimidoyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F036-0963
4-fluoro-N-[(E)-N-[2-(1H-indol-3-yl)ethyl]-N'-phenylcarbamimidoyl]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

F036-0963

Molecular Formula

C24H21FN4O (C24 H21 FN4 O)

Compound Name

4-fluoro-N-[(E)-N-[2-(1H-indol-3-yl)ethyl]-N'-phenylcarbamimidoyl]benzamide

IUPAC name

4-fluoro-N-[(E)-N-[2-(1H-indol-3-yl)ethyl]-N'-phenylcarbamimidoyl]benzamide

SMILES

O=C(c(cc1)ccc1F)N/C(/NCCc1c[nH]c2c1cccc2)=N/c1ccccc1

InChI

InChI=1S/C24H21FN4O/c25-19-12-10-17(11-13-19)23(30)29-24(28-20-6-2-1-3-7-20)26-15-14-18-16-27-22-9-5-4-8-21(18)22/h1-13,16,27H,14-15H2,(H2,26,28,29,30)

InChI Key

HGOSCFNDTZONOB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14937619

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.46

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.336

Distribution Coefficient, logD

4.138

Water Solubility, LogSw

-4.45

Polar Surface Area

51.564

Acid Dissociation Constant (pKa)

9.34

Base Dissociation Constant (pKb)

7.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

References: we are preparing a list of scientific research reports with F036-0963 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F036-0963?
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What is the minimum amount of F036-0963 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F036-0963
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F036-0963
  • 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 F036-0963 available by request