F036-1967 Screening compound: 3-bromo-N-[(E)-N'-(3-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]benzamide

F036-1967 Screening compound: 3-bromo-N-[(E)-N'-(3-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]benzamide
F036-1967 Screening compound: 3-bromo-N-[(E)-N'-(3-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F036-1967
3-bromo-N-[(E)-N'-(3-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]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

F036-1967

Molecular Formula

C24H20BrFN4O (C24 H20 BrFN4 O)

Compound Name

3-bromo-N-[(E)-N'-(3-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]benzamide

IUPAC name

3-bromo-N-[(E)-N'-(3-fluorophenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]benzamide

SMILES

O=C(c1cccc(Br)c1)N/C(/NCCc1c[nH]c2c1cccc2)=N/c1cc(F)ccc1

InChI

InChI=1S/C24H20BrFN4O/c25-18-6-3-5-16(13-18)23(31)30-24(29-20-8-4-7-19(26)14-20)27-12-11-17-15-28-22-10-2-1-9-21(17)22/h1-10,13-15,28H,11-12H2,(H2,27,29,30,31)

InChI Key

BOPUWVOIKAUSBW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14937870

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.35

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

5.533

Distribution Coefficient, logD

5.459

Water Solubility, LogSw

-6.15

Polar Surface Area

51.564

Acid Dissociation Constant (pKa)

8.44

Base Dissociation Constant (pKb)

6.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

References: we are preparing a list of scientific research reports with F036-1967 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F036-1967?
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What is the minimum amount of F036-1967 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F036-1967
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F036-1967
  • 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 F036-1967 available by request