Y020-7993 Screening compound: 3-[(furan-2-yl)methyl]-4-imino-3,4-dihydroquinazoline-2-thiol

Y020-7993 Screening compound: 3-[(furan-2-yl)methyl]-4-imino-3,4-dihydroquinazoline-2-thiol
Y020-7993 Screening compound: 3-[(furan-2-yl)methyl]-4-imino-3,4-dihydroquinazoline-2-thiol alternative view

Chemical Structure Depiction of ChemDiv screening compound Y020-7993
3-[(furan-2-yl)methyl]-4-imino-3,4-dihydroquinazoline-2-thiol

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

Y020-7993

Molecular Formula

C13H11N3OS (C13 H11 N3 OS)

Compound Name

3-[(furan-2-yl)methyl]-4-imino-3,4-dihydroquinazoline-2-thiol

IUPAC name

3-[(furan-2-yl)methyl]-4-imino-34-dihydroquinazoline-2-thiol

SMILES

N=C1N(Cc2ccco2)C(S)=Nc2c1cccc2

InChI

InChI=1S/C13H11N3OS/c14-12-10-5-1-2-6-11(10)15-13(18)16(12)8-9-4-3-7-17-9/h1-7,14H,8H2,(H,15,18)

InChI Key

YYSJASRHTHYENJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08088896

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

257.32

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.142

Distribution Coefficient, logD

2.142

Water Solubility, LogSw

-2.92

Polar Surface Area

36.993

Acid Dissociation Constant (pKa)

2.91

Base Dissociation Constant (pKb)

15.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.70

Y020-7993 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 Y020-7993 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y020-7993?
Check Price and Availability of Y020-7993, 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 Y020-7993 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y020-7993
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y020-7993
  • 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 Y020-7993 available by request