F036-2083 Screening compound: 4-chloro-N-[(E)-N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]benzamide

F036-2083 Screening compound: 4-chloro-N-[(E)-N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]benzamide
F036-2083 Screening compound: 4-chloro-N-[(E)-N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F036-2083
4-chloro-N-[(E)-N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]benzamide

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

F036-2083

Molecular Formula

C26H23ClN4O3 (C26 H23 ClN4 O3)

Compound Name

4-chloro-N-[(E)-N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]benzamide

IUPAC name

4-chloro-N-[(E)-N'-(23-dihydro-14-benzodioxin-6-yl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]benzamide

SMILES

O=C(c(cc1)ccc1Cl)N/C(/NCCc1c[nH]c2c1cccc2)=N/c(cc1)cc2c1OCCO2

InChI

InChI=1S/C26H23ClN4O3/c27-19-7-5-17(6-8-19)25(32)31-26(30-20-9-10-23-24(15-20)34-14-13-33-23)28-12-11-18-16-29-22-4-2-1-3-21(18)22/h1-10,15-16,29H,11-14H2,(H2,28,30,31,32)

InChI Key

MRHWTJRHQIRJBS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14937885

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.95

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.299

Distribution Coefficient, logD

3.734

Water Solubility, LogSw

-4.73

Polar Surface Area

67.387

Acid Dissociation Constant (pKa)

9.64

Base Dissociation Constant (pKb)

7.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

References: we are preparing a list of scientific research reports with F036-2083 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F036-2083?
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What is the minimum amount of F036-2083 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F036-2083
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F036-2083
  • 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 F036-2083 available by request