Y010-0390 Screening compound: 2-benzyl-8-methoxy-4,4-dimethyl-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinoline-1-thione

Y010-0390 Screening compound: 2-benzyl-8-methoxy-4,4-dimethyl-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinoline-1-thione
Y010-0390 Screening compound: 2-benzyl-8-methoxy-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 Y010-0390
2-benzyl-8-methoxy-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

Y010-0390

Molecular Formula

C20H20N2OS2 (C20 H20 N2 OS2)

Compound Name

2-benzyl-8-methoxy-4,4-dimethyl-1H,2H,4H,5H-[1,2]thiazolo[5,4-c]quinoline-1-thione

IUPAC name

2-benzyl-8-methoxy-44-dimethyl-1H2H4H5H-[12]thiazolo[54-c]quinoline-1-thione

SMILES

CC1(C)Nc(ccc(OC)c2)c2C2=C1SN(Cc1ccccc1)C2=S

InChI

InChI=1S/C20H20N2OS2/c1-20(2)18-17(15-11-14(23-3)9-10-16(15)21-20)19(24)22(25-18)12-13-7-5-4-6-8-13/h4-11,21H,12H2,1-3H3

InChI Key

MZYXHCDPIHKPQW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06243131

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.52

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

5.023

Distribution Coefficient, logD

5.021

Water Solubility, LogSw

-4.70

Polar Surface Area

23.301

Acid Dissociation Constant (pKa)

18.97

Base Dissociation Constant (pKb)

5.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

Y010-0390 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y010-0390 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y010-0390?
Check Price and Availability of Y010-0390, 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 Y010-0390 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y010-0390
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y010-0390
  • 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 Y010-0390 available by request