F036-1055 Screening compound: N-[(E)-N'-(3,4-dimethoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-3-acetamidobenzamide

F036-1055 Screening compound: N-[(E)-N'-(3,4-dimethoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-3-acetamidobenzamide
F036-1055 Screening compound: N-[(E)-N'-(3,4-dimethoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-3-acetamidobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F036-1055
N-[(E)-N'-(3,4-dimethoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-3-acetamidobenzamide

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

F036-1055

Molecular Formula

C28H29N5O4 (C28 H29 N5 O4)

Compound Name

N-[(E)-N'-(3,4-dimethoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-3-acetamidobenzamide

IUPAC name

N-[(E)-N'-(34-dimethoxyphenyl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]-3-acetamidobenzamide

SMILES

CC(Nc1cccc(C(N/C(/NCCc2c[nH]c3c2cccc3)=N/c(cc2)cc(OC)c2OC)=O)c1)=O

InChI

InChI=1S/C28H29N5O4/c1-18(34)31-21-8-6-7-19(15-21)27(35)33-28(32-22-11-12-25(36-2)26(16-22)37-3)29-14-13-20-17-30-24-10-5-4-9-23(20)24/h4-12,15-17,30H,13-14H2,1-3H3,(H,31,34)(H2,29,32,33,35)

InChI Key

PGTKIKDBYYBHJY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14937633

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.768

Distribution Coefficient, logD

3.400

Water Solubility, LogSw

-4.14

Polar Surface Area

90.086

Acid Dissociation Constant (pKa)

10.53

Base Dissociation Constant (pKb)

7.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.90

References: we are preparing a list of scientific research reports with F036-1055 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F036-1055?
Check Price and Availability of F036-1055, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of F036-1055 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F036-1055
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F036-1055
  • 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 F036-1055 available by request