F036-1170 Screening compound: 3-fluoro-N-[(E)-N-[2-(1H-indol-3-yl)ethyl]-N'-(2-methylphenyl)carbamimidoyl]-4-methylbenzamide

F036-1170 Screening compound: 3-fluoro-N-[(E)-N-[2-(1H-indol-3-yl)ethyl]-N'-(2-methylphenyl)carbamimidoyl]-4-methylbenzamide
F036-1170 Screening compound: 3-fluoro-N-[(E)-N-[2-(1H-indol-3-yl)ethyl]-N'-(2-methylphenyl)carbamimidoyl]-4-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F036-1170
3-fluoro-N-[(E)-N-[2-(1H-indol-3-yl)ethyl]-N'-(2-methylphenyl)carbamimidoyl]-4-methylbenzamide

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

F036-1170

Molecular Formula

C26H25FN4O (C26 H25 FN4 O)

Compound Name

3-fluoro-N-[(E)-N-[2-(1H-indol-3-yl)ethyl]-N'-(2-methylphenyl)carbamimidoyl]-4-methylbenzamide

IUPAC name

3-fluoro-N-[(E)-N-[2-(1H-indol-3-yl)ethyl]-N'-(2-methylphenyl)carbamimidoyl]-4-methylbenzamide

SMILES

Cc(cccc1)c1/N=C(\NCCc1c[nH]c2c1cccc2)/NC(c1cc(F)c(C)cc1)=O

InChI

InChI=1S/C26H25FN4O/c1-17-11-12-19(15-22(17)27)25(32)31-26(30-23-9-5-3-7-18(23)2)28-14-13-20-16-29-24-10-6-4-8-21(20)24/h3-12,15-16,29H,13-14H2,1-2H3,(H2,28,30,31,32)

InChI Key

FHLFTOJVXPRJGL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14937652

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.51

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

5.539

Distribution Coefficient, logD

5.305

Water Solubility, LogSw

-5.64

Polar Surface Area

50.866

Acid Dissociation Constant (pKa)

8.74

Base Dissociation Constant (pKb)

7.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

References: we are preparing a list of scientific research reports with F036-1170 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F036-1170?
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What is the minimum amount of F036-1170 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F036-1170
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F036-1170
  • 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 F036-1170 available by request