V007-9810 Screening compound: tert-butyl 2-{[3-(2,5-dichlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetate

V007-9810 Screening compound: tert-butyl 2-{[3-(2,5-dichlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetate
V007-9810 Screening compound: tert-butyl 2-{[3-(2,5-dichlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-9810
tert-butyl 2-{[3-(2,5-dichlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetate

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

V007-9810

Molecular Formula

C20H18Cl2N2O3S (C20 H18 Cl2 N2 O3 S)

Compound Name

tert-butyl 2-{[3-(2,5-dichlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetate

IUPAC name

tert-butyl 2-{[3-(25-dichlorophenyl)-4-oxo-34-dihydroquinazolin-2-yl]sulfanyl}acetate

SMILES

CC(C)(C)OC(CSC(N1c(cc(cc2)Cl)c2Cl)=Nc(cccc2)c2C1=O)=O

InChI

InChI=1S/C20H18Cl2N2O3S/c1-20(2,3)27-17(25)11-28-19-23-15-7-5-4-6-13(15)18(26)24(19)16-10-12(21)8-9-14(16)22/h4-10H,11H2,1-3H3

InChI Key

GUQOPZUJLRPAQY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19855510

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.35

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.835

Distribution Coefficient, logD

4.835

Water Solubility, LogSw

-4.89

Polar Surface Area

44.398

Acid Dissociation Constant (pKa)

30.72

Base Dissociation Constant (pKb)

3.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

V007-9810 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V007-9810 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-9810?
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What is the minimum amount of V007-9810 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-9810
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-9810
  • 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 V007-9810 available by request