F036-1339 Screening compound: 3-chloro-N-[(E)-N'-(2-ethoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-4-fluorobenzamide

F036-1339 Screening compound: 3-chloro-N-[(E)-N'-(2-ethoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-4-fluorobenzamide
F036-1339 Screening compound: 3-chloro-N-[(E)-N'-(2-ethoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-4-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F036-1339
3-chloro-N-[(E)-N'-(2-ethoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-4-fluorobenzamide

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

F036-1339

Molecular Formula

C26H24ClFN4O2 (C26 H24 ClFN4 O2)

Compound Name

3-chloro-N-[(E)-N'-(2-ethoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-4-fluorobenzamide

IUPAC name

3-chloro-N-[(E)-N'-(2-ethoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-4-fluorobenzamide

SMILES

CCOc(cccc1)c1/N=C(\NCCc1c[nH]c2c1cccc2)/NC(c(cc1)cc(Cl)c1F)=O

InChI

InChI=1S/C26H24ClFN4O2/c1-2-34-24-10-6-5-9-23(24)31-26(32-25(33)17-11-12-21(28)20(27)15-17)29-14-13-18-16-30-22-8-4-3-7-19(18)22/h3-12,15-16,30H,2,13-14H2,1H3,(H2,29,31,32,33)

InChI Key

VJMCOIMUZWAVMW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14937676

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.95

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.336

Distribution Coefficient, logD

5.260

Water Solubility, LogSw

-5.98

Polar Surface Area

58.076

Acid Dissociation Constant (pKa)

9.05

Base Dissociation Constant (pKb)

6.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

References: we are preparing a list of scientific research reports with F036-1339 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F036-1339?
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What is the minimum amount of F036-1339 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F036-1339
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F036-1339
  • 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 F036-1339 available by request