3807-4025 Screening compound: 2-(4-chloro-3-fluorophenyl)-4,4,7-trimethyl-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinoline-1-thione

3807-4025 Screening compound: 2-(4-chloro-3-fluorophenyl)-4,4,7-trimethyl-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinoline-1-thione
3807-4025 Screening compound: 2-(4-chloro-3-fluorophenyl)-4,4,7-trimethyl-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinoline-1-thione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3807-4025
2-(4-chloro-3-fluorophenyl)-4,4,7-trimethyl-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinoline-1-thione

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

3807-4025

Molecular Formula

C19H16ClFN2S2 (C19 H16 ClFN2 S2)

Compound Name

2-(4-chloro-3-fluorophenyl)-4,4,7-trimethyl-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinoline-1-thione

IUPAC name

2-(4-chloro-3-fluorophenyl)-447-trimethyl-1H2H4H5H-[12]thiazolo[54-c]quinoline-1-thione

SMILES

CC1(C)Nc(cc(C)cc2)c2C(C2=S)=C1SN2c(cc1)cc(F)c1Cl

InChI

InChI=1S/C19H16ClFN2S2/c1-10-4-6-12-15(8-10)22-19(2,3)17-16(12)18(24)23(25-17)11-5-7-13(20)14(21)9-11/h4-9,22H,1-3H3

InChI Key

WACHXOWLDYHMIH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01051587

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.93

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.738

Distribution Coefficient, logD

5.659

Water Solubility, LogSw

-6.35

Polar Surface Area

14.706

Acid Dissociation Constant (pKa)

18.22

Base Dissociation Constant (pKb)

-3.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

3807-4025 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

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 3807-4025 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3807-4025?
Check Price and Availability of 3807-4025, 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 3807-4025 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3807-4025
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3807-4025
  • 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 3807-4025 available by request