V004-1831 Screening compound: 4-FLUORO-2-METHOXY-N-(2-{[2-(THIOPHEN-2-YL)QUINAZOLIN-4-YL]AMINO}ETHYL)BENZENE-1-SULFONAMIDE

V004-1831 Screening compound: 4-FLUORO-2-METHOXY-N-(2-{[2-(THIOPHEN-2-YL)QUINAZOLIN-4-YL]AMINO}ETHYL)BENZENE-1-SULFONAMIDE
V004-1831 Screening compound: 4-FLUORO-2-METHOXY-N-(2-{[2-(THIOPHEN-2-YL)QUINAZOLIN-4-YL]AMINO}ETHYL)BENZENE-1-SULFONAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-1831
4-FLUORO-2-METHOXY-N-(2-{[2-(THIOPHEN-2-YL)QUINAZOLIN-4-YL]AMINO}ETHYL)BENZENE-1-SULFONAMIDE

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

V004-1831

Molecular Formula

C21H19FN4O3S2 (C21 H19 FN4 O3 S2)

Compound Name

4-FLUORO-2-METHOXY-N-(2-{[2-(THIOPHEN-2-YL)QUINAZOLIN-4-YL]AMINO}ETHYL)BENZENE-1-SULFONAMIDE

IUPAC name

n/a

SMILES

COc(cc(cc1)F)c1S(NCCNc1nc(-c2cccs2)nc2ccccc12)(=O)=O

InChI

InChI=1S/C21H19FN4O3S2/c1-29-17-13-14(22)8-9-19(17)31(27,28)24-11-10-23-20-15-5-2-3-6-16(15)25-21(26-20)18-7-4-12-30-18/h2-9,12-13,24H,10-11H2,1H3,(H,23,25,26)

InChI Key

VKNNEGAJOIPPIN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20494274

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

458.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.607

Distribution Coefficient, logD

4.600

Water Solubility, LogSw

-4.38

Polar Surface Area

79.489

Acid Dissociation Constant (pKa)

10.99

Base Dissociation Constant (pKb)

5.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

V004-1831 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

GPCR Targeted Library (31838 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Antiviral
  • Infections
  • Immune system
Targets:
  • GPCR
  • Others
Mechanism of action:
  • Receptor's ligands
  • Epigenetic

References: we are preparing a list of scientific research reports with V004-1831 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-1831?
Check Price and Availability of V004-1831, 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 V004-1831 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-1831
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-1831
  • 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 V004-1831 available by request