V005-9580 Screening compound: 3-(4-CHLOROPHENYL)-2-(ETHYLSULFANYL)-4(3H)-QUINAZOLINONE

V005-9580 Screening compound: 3-(4-CHLOROPHENYL)-2-(ETHYLSULFANYL)-4(3H)-QUINAZOLINONE
V005-9580 Screening compound: 3-(4-CHLOROPHENYL)-2-(ETHYLSULFANYL)-4(3H)-QUINAZOLINONE alternative view

Chemical Structure Depiction of ChemDiv screening compound V005-9580
3-(4-CHLOROPHENYL)-2-(ETHYLSULFANYL)-4(3H)-QUINAZOLINONE

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

V005-9580

Molecular Formula

C16H13ClN2OS (C16 H13 ClN2 OS)

Compound Name

3-(4-CHLOROPHENYL)-2-(ETHYLSULFANYL)-4(3H)-QUINAZOLINONE

IUPAC name

n/a

SMILES

CCSC(N1c(cc2)ccc2Cl)=Nc(cccc2)c2C1=O

InChI

InChI=1S/C16H13ClN2OS/c1-2-21-16-18-14-6-4-3-5-13(14)15(20)19(16)12-9-7-11(17)8-10-12/h3-10H,2H2,1H3

InChI Key

JJBYELQFFNALRS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03084722

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.81

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.757

Distribution Coefficient, logD

3.757

Water Solubility, LogSw

-4.31

Polar Surface Area

25.431

Acid Dissociation Constant (pKa)

30.32

Base Dissociation Constant (pKb)

3.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

V005-9580 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with V005-9580 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V005-9580?
Check Price and Availability of V005-9580, 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 V005-9580 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V005-9580
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V005-9580
  • 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 V005-9580 available by request