V007-1346 Screening compound: 2-{[(4-tert-butylphenyl)methyl]sulfanyl}-3-(4-fluorophenyl)-3,4-dihydroquinazolin-4-one

V007-1346 Screening compound: 2-{[(4-tert-butylphenyl)methyl]sulfanyl}-3-(4-fluorophenyl)-3,4-dihydroquinazolin-4-one
V007-1346 Screening compound: 2-{[(4-tert-butylphenyl)methyl]sulfanyl}-3-(4-fluorophenyl)-3,4-dihydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-1346
2-{[(4-tert-butylphenyl)methyl]sulfanyl}-3-(4-fluorophenyl)-3,4-dihydroquinazolin-4-one

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

V007-1346

Molecular Formula

C25H23FN2OS (C25 H23 FN2 OS)

Compound Name

2-{[(4-tert-butylphenyl)methyl]sulfanyl}-3-(4-fluorophenyl)-3,4-dihydroquinazolin-4-one

IUPAC name

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

SMILES

CC(C)(C)c1ccc(CSC(N2c(cc3)ccc3F)=Nc(cccc3)c3C2=O)cc1

InChI

InChI=1S/C25H23FN2OS/c1-25(2,3)18-10-8-17(9-11-18)16-30-24-27-22-7-5-4-6-21(22)23(29)28(24)20-14-12-19(26)13-15-20/h4-15H,16H2,1-3H3

InChI Key

JPYYJQATIPCTSW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06397194

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.53

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.722

Distribution Coefficient, logD

5.722

Water Solubility, LogSw

-5.47

Polar Surface Area

25.159

Acid Dissociation Constant (pKa)

30.17

Base Dissociation Constant (pKb)

3.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

V007-1346 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

PI3K-Targeted Library (17255 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
  • Kinases
  • Proteases

References: we are preparing a list of scientific research reports with V007-1346 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-1346?
Check Price and Availability of V007-1346, 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 V007-1346 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-1346
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-1346
  • 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 V007-1346 available by request