3535-0128 Screening compound: 8-chloro-2-(3-methoxyphenyl)-4,4-dimethyl-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinoline-1-thione

3535-0128 Screening compound: 8-chloro-2-(3-methoxyphenyl)-4,4-dimethyl-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinoline-1-thione
3535-0128 Screening compound: 8-chloro-2-(3-methoxyphenyl)-4,4-dimethyl-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinoline-1-thione alternative view

Chemical Structure Depiction of ChemDiv screening compound 3535-0128
8-chloro-2-(3-methoxyphenyl)-4,4-dimethyl-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

3535-0128

Molecular Formula

C19H17ClN2OS2 (C19 H17 ClN2 OS2)

Compound Name

8-chloro-2-(3-methoxyphenyl)-4,4-dimethyl-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinoline-1-thione

IUPAC name

8-chloro-2-(3-methoxyphenyl)-44-dimethyl-1H2H4H5H-[12]thiazolo[54-c]quinoline-1-thione

SMILES

CC1(C)Nc(ccc(Cl)c2)c2C(C2=S)=C1SN2c1cc(OC)ccc1

InChI

InChI=1S/C19H17ClN2OS2/c1-19(2)17-16(14-9-11(20)7-8-15(14)21-19)18(24)22(25-17)12-5-4-6-13(10-12)23-3/h4-10,21H,1-3H3

InChI Key

MGWGLXXVQZBNFW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01959915

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.94

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.842

Distribution Coefficient, logD

5.342

Water Solubility, LogSw

-6.12

Polar Surface Area

22.250

Acid Dissociation Constant (pKa)

16.25

Base Dissociation Constant (pKb)

7.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

3535-0128 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 3535-0128 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3535-0128?
Check Price and Availability of 3535-0128, 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 3535-0128 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3535-0128
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3535-0128
  • 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 3535-0128 available by request