F036-2085 Screening compound: 3-chloro-N-[(Z)-N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]benzamide

F036-2085 Screening compound: 3-chloro-N-[(Z)-N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl]benzamide
F036-2085 Screening compound: 3-chloro-N-[(Z)-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 F036-2085
3-chloro-N-[(Z)-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

F036-2085

Molecular Formula

C26H23ClN4O3 (C26 H23 ClN4 O3)

Compound Name

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

IUPAC name

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

SMILES

O=C(c1cccc(Cl)c1)N/C(/NCCc1c[nH]c2c1cccc2)=N\c(cc1)cc2c1OCCO2

InChI

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

InChI Key

QJOLFPQWCFXNQI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14937887

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

4.367

Distribution Coefficient, logD

3.802

Water Solubility, LogSw

-4.64

Polar Surface Area

67.387

Acid Dissociation Constant (pKa)

9.68

Base Dissociation Constant (pKb)

7.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

F036-2085 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with F036-2085 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F036-2085?
Check Price and Availability of F036-2085, 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 F036-2085 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F036-2085
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F036-2085
  • 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 F036-2085 available by request