F036-1396 Screening compound: N-[(E)-N-[2-(1H-indol-3-yl)ethyl]-N'-(3-methoxyphenyl)carbamimidoyl]-3,5-dimethoxybenzamide

F036-1396 Screening compound: N-[(E)-N-[2-(1H-indol-3-yl)ethyl]-N'-(3-methoxyphenyl)carbamimidoyl]-3,5-dimethoxybenzamide
F036-1396 Screening compound: N-[(E)-N-[2-(1H-indol-3-yl)ethyl]-N'-(3-methoxyphenyl)carbamimidoyl]-3,5-dimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F036-1396
N-[(E)-N-[2-(1H-indol-3-yl)ethyl]-N'-(3-methoxyphenyl)carbamimidoyl]-3,5-dimethoxybenzamide

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

F036-1396

Molecular Formula

C27H28N4O4 (C27 H28 N4 O4)

Compound Name

N-[(E)-N-[2-(1H-indol-3-yl)ethyl]-N'-(3-methoxyphenyl)carbamimidoyl]-3,5-dimethoxybenzamide

IUPAC name

N-[(E)-N-[2-(1H-indol-3-yl)ethyl]-N'-(3-methoxyphenyl)carbamimidoyl]-35-dimethoxybenzamide

SMILES

COc1cccc(/N=C(\NCCc2c[nH]c3c2cccc3)/NC(c2cc(OC)cc(OC)c2)=O)c1

InChI

InChI=1S/C27H28N4O4/c1-33-21-8-6-7-20(15-21)30-27(28-12-11-18-17-29-25-10-5-4-9-24(18)25)31-26(32)19-13-22(34-2)16-23(14-19)35-3/h4-10,13-17,29H,11-12H2,1-3H3,(H2,28,30,31,32)

InChI Key

DTPRXDMPXCHVLW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14937714

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.038

Distribution Coefficient, logD

4.900

Water Solubility, LogSw

-4.87

Polar Surface Area

74.195

Acid Dissociation Constant (pKa)

11.80

Base Dissociation Constant (pKb)

6.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.50

References: we are preparing a list of scientific research reports with F036-1396 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F036-1396?
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What is the minimum amount of F036-1396 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F036-1396
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F036-1396
  • 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 F036-1396 available by request