8019-6947 Screening compound: 4-[4-(5-quinolyl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]phenol

8019-6947 Screening compound: 4-[4-(5-quinolyl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]phenol
8019-6947 Screening compound: 4-[4-(5-quinolyl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-6947
4-[4-(5-quinolyl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]phenol

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

8019-6947

Molecular Formula

C17H12N4OS (C17 H12 N4 OS)

Compound Name

4-[4-(5-quinolyl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]phenol

IUPAC name

n/a

SMILES

Oc(cc1)ccc1-c(n1-c2cccc3ncccc23)nnc1S

InChI

InChI=1S/C17H12N4OS/c22-12-8-6-11(7-9-12)16-19-20-17(23)21(16)15-5-1-4-14-13(15)3-2-10-18-14/h1-10,22H,(H,20,23)

InChI Key

VSNLAZKVACCHNA-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

320.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.778

Distribution Coefficient, logD

1.412

Water Solubility, LogSw

-2.87

Polar Surface Area

49.537

Acid Dissociation Constant (pKa)

6.05

Base Dissociation Constant (pKb)

4.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8019-6947 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8019-6947 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-6947?
Check Price and Availability of 8019-6947, 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 8019-6947 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-6947
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-6947
  • 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 8019-6947 available by request