F036-0741 Screening compound: N-[(E)-N'-(3,5-dimethylphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-3,4-diethoxybenzamide

F036-0741 Screening compound: N-[(E)-N'-(3,5-dimethylphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-3,4-diethoxybenzamide
F036-0741 Screening compound: N-[(E)-N'-(3,5-dimethylphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-3,4-diethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F036-0741
N-[(E)-N'-(3,5-dimethylphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-3,4-diethoxybenzamide

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

F036-0741

Molecular Formula

C30H34N4O3 (C30 H34 N4 O3)

Compound Name

N-[(E)-N'-(3,5-dimethylphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-3,4-diethoxybenzamide

IUPAC name

N-[(E)-N'-(35-dimethylphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-34-diethoxybenzamide

SMILES

CCOc(ccc(C(N/C(/NCCc1c[nH]c2c1cccc2)=N/c1cc(C)cc(C)c1)=O)c1)c1OCC

InChI

InChI=1S/C30H34N4O3/c1-5-36-27-12-11-22(18-28(27)37-6-2)29(35)34-30(33-24-16-20(3)15-21(4)17-24)31-14-13-23-19-32-26-10-8-7-9-25(23)26/h7-12,15-19,32H,5-6,13-14H2,1-4H3,(H2,31,33,34,35)

InChI Key

YDLRVHYGPAOTDO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14937584

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.63

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.597

Distribution Coefficient, logD

4.936

Water Solubility, LogSw

-5.68

Polar Surface Area

65.984

Acid Dissociation Constant (pKa)

12.63

Base Dissociation Constant (pKb)

7.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

References: we are preparing a list of scientific research reports with F036-0741 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F036-0741?
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What is the minimum amount of F036-0741 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F036-0741
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F036-0741
  • 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 F036-0741 available by request