V002-7165 Screening compound: 3-(2-fluorophenyl)-2-[(4-nitrobenzyl)sulfanyl]-4(3H)-quinazolinone

V002-7165 Screening compound: 3-(2-fluorophenyl)-2-[(4-nitrobenzyl)sulfanyl]-4(3H)-quinazolinone
V002-7165 Screening compound: 3-(2-fluorophenyl)-2-[(4-nitrobenzyl)sulfanyl]-4(3H)-quinazolinone alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-7165
3-(2-fluorophenyl)-2-[(4-nitrobenzyl)sulfanyl]-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

V002-7165

Molecular Formula

C21H14FN3O3S (C21 H14 FN3 O3 S)

Compound Name

3-(2-fluorophenyl)-2-[(4-nitrobenzyl)sulfanyl]-4(3H)-quinazolinone

IUPAC name

3-(2-fluorophenyl)-2-{[(4-nitrophenyl)methyl]sulfanyl}-34-dihydroquinazolin-4-one

SMILES

[O-][N+](c1ccc(CSC(N2c(cccc3)c3F)=Nc(cccc3)c3C2=O)cc1)=O

InChI

InChI=1S/C21H14FN3O3S/c22-17-6-2-4-8-19(17)24-20(26)16-5-1-3-7-18(16)23-21(24)29-13-14-9-11-15(12-10-14)25(27)28/h1-12H,13H2

InChI Key

LZDJKJRNXRBWFO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05268464

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.42

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.875

Distribution Coefficient, logD

3.875

Water Solubility, LogSw

-4.19

Polar Surface Area

58.240

Acid Dissociation Constant (pKa)

34.12

Base Dissociation Constant (pKb)

3.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.76

V002-7165 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with V002-7165 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-7165?
Check Price and Availability of V002-7165, 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 V002-7165 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-7165
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-7165
  • 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 V002-7165 available by request