3505-6173 Screening compound: 8-ethyl-2-(4-methoxyphenyl)-4,4-dimethyl-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinoline-1-thione

3505-6173 Screening compound: 8-ethyl-2-(4-methoxyphenyl)-4,4-dimethyl-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinoline-1-thione
3505-6173 Screening compound: 8-ethyl-2-(4-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 3505-6173
8-ethyl-2-(4-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

3505-6173

Molecular Formula

C21H22N2OS2 (C21 H22 N2 OS2)

Compound Name

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

IUPAC name

8-ethyl-2-(4-methoxyphenyl)-44-dimethyl-1H2H4H5H-[12]thiazolo[54-c]quinoline-1-thione

SMILES

CCc(cc1)cc2c1NC(C)(C)C(SN1c(cc3)ccc3OC)=C2C1=S

InChI

InChI=1S/C21H22N2OS2/c1-5-13-6-11-17-16(12-13)18-19(21(2,3)22-17)26-23(20(18)25)14-7-9-15(24-4)10-8-14/h6-12,22H,5H2,1-4H3

InChI Key

IADZMBDJEWGVRK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01975594

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.55

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.950

Distribution Coefficient, logD

4.871

Water Solubility, LogSw

-5.62

Polar Surface Area

22.250

Acid Dissociation Constant (pKa)

17.92

Base Dissociation Constant (pKb)

8.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with 3505-6173 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3505-6173?
Check Price and Availability of 3505-6173, 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 3505-6173 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3505-6173
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3505-6173
  • 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 3505-6173 available by request