7745-1508 Screening compound: [2-({5-butyl-8-fluoro-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)ethyl]diethylamine

7745-1508 Screening compound: [2-({5-butyl-8-fluoro-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)ethyl]diethylamine
7745-1508 Screening compound: [2-({5-butyl-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 7745-1508
[2-({5-butyl-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

7745-1508

Molecular Formula

C19H26FN5S (C19 H26 FN5 S)

Compound Name

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

IUPAC name

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

SMILES

CCCCn1c2nc(SCCN(CC)CC)nnc2c2c1ccc(F)c2

InChI

InChI=1S/C19H26FN5S/c1-4-7-10-25-16-9-8-14(20)13-15(16)17-18(25)21-19(23-22-17)26-12-11-24(5-2)6-3/h8-9,13H,4-7,10-12H2,1-3H3

InChI Key

ZGNHGIGBHCYJKW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14712978

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.394

Distribution Coefficient, logD

2.354

Water Solubility, LogSw

-4.06

Polar Surface Area

36.639

Acid Dissociation Constant (pKa)

23.11

Base Dissociation Constant (pKb)

9.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.60

7745-1508 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-infective Library (19449 compounds)

Antiviral Library (67538 compounds)

DGK Inhibitors Library (10558 compounds)

Human Kinases Annotated Library (2415 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 7745-1508 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7745-1508?
Check Price and Availability of 7745-1508, 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 7745-1508 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7745-1508
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7745-1508
  • 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 7745-1508 available by request