7745-1519 Screening compound: [2-({5-benzyl-8-fluoro-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)ethyl]diethylamine

7745-1519 Screening compound: [2-({5-benzyl-8-fluoro-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)ethyl]diethylamine
7745-1519 Screening compound: [2-({5-benzyl-8-fluoro-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)ethyl]diethylamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 7745-1519
[2-({5-benzyl-8-fluoro-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)ethyl]diethylamine

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

7745-1519

Molecular Formula

C22H24FN5S (C22 H24 FN5 S)

Compound Name

[2-({5-benzyl-8-fluoro-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)ethyl]diethylamine

IUPAC name

[2-({5-benzyl-8-fluoro-5H-[124]triazino[56-b]indol-3-yl}sulfanyl)ethyl]diethylamine

SMILES

CCN(CC)CCSc1nnc(c(cc(cc2)F)c2n2Cc3ccccc3)c2n1

InChI

InChI=1S/C22H24FN5S/c1-3-27(4-2)12-13-29-22-24-21-20(25-26-22)18-14-17(23)10-11-19(18)28(21)15-16-8-6-5-7-9-16/h5-11,14H,3-4,12-13,15H2,1-2H3

InChI Key

UXAROFFSVQHOTD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14712980

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.682

Distribution Coefficient, logD

2.642

Water Solubility, LogSw

-4.36

Polar Surface Area

36.389

Acid Dissociation Constant (pKa)

23.11

Base Dissociation Constant (pKb)

9.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

7745-1519 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Antiviral Library (67538 compounds)

CNS Targets (44014 compounds)

CNS targets activity set (6557 compounds)

Human GPCR Annotated Library (5539 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 7745-1519 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7745-1519?
Check Price and Availability of 7745-1519, 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 7745-1519 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7745-1519
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7745-1519
  • 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 7745-1519 available by request