7745-1487 Screening compound: 1-[2-({5-ethyl-8-fluoro-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)ethyl]piperidine

7745-1487 Screening compound: 1-[2-({5-ethyl-8-fluoro-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)ethyl]piperidine
7745-1487 Screening compound: 1-[2-({5-ethyl-8-fluoro-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)ethyl]piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 7745-1487
1-[2-({5-ethyl-8-fluoro-5H-[1,2,4]triazino[5,6-b]indol-3-yl}sulfanyl)ethyl]piperidine

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

7745-1487

Molecular Formula

C18H22FN5S (C18 H22 FN5 S)

Compound Name

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

IUPAC name

1-[2-({5-ethyl-8-fluoro-5H-[124]triazino[56-b]indol-3-yl}sulfanyl)ethyl]piperidine

SMILES

CCn1c2nc(SCCN3CCCCC3)nnc2c2c1ccc(F)c2

InChI

InChI=1S/C18H22FN5S/c1-2-24-15-7-6-13(19)12-14(15)16-17(24)20-18(22-21-16)25-11-10-23-8-4-3-5-9-23/h6-7,12H,2-5,8-11H2,1H3

InChI Key

JEUZKQDHFSTYJA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06605466

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.481

Distribution Coefficient, logD

1.565

Water Solubility, LogSw

-3.69

Polar Surface Area

36.686

Acid Dissociation Constant (pKa)

23.11

Base Dissociation Constant (pKb)

9.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

7745-1487 in Drug Discovery

Included in Screening Libraries

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 7745-1487 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7745-1487?
Check Price and Availability of 7745-1487, 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 7745-1487 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7745-1487
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7745-1487
  • 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 7745-1487 available by request