V013-8463 Screening compound: N-(2-{[2-(4-chlorophenyl)quinazolin-4-yl]amino}ethyl)-3-(trifluoromethyl)benzene-1-sulfonamide

V013-8463 Screening compound: N-(2-{[2-(4-chlorophenyl)quinazolin-4-yl]amino}ethyl)-3-(trifluoromethyl)benzene-1-sulfonamide
V013-8463 Screening compound: N-(2-{[2-(4-chlorophenyl)quinazolin-4-yl]amino}ethyl)-3-(trifluoromethyl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-8463
N-(2-{[2-(4-chlorophenyl)quinazolin-4-yl]amino}ethyl)-3-(trifluoromethyl)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

V013-8463

Molecular Formula

C23H18ClF3N4O2S (C23 H18 ClF3 N4 O2 S)

Compound Name

N-(2-{[2-(4-chlorophenyl)quinazolin-4-yl]amino}ethyl)-3-(trifluoromethyl)benzene-1-sulfonamide

IUPAC name

N-(2-{[2-(4-chlorophenyl)quinazolin-4-yl]amino}ethyl)-3-(trifluoromethyl)benzene-1-sulfonamide

SMILES

O=S(c1cc(C(F)(F)F)ccc1)(NCCNc1nc(-c(cc2)ccc2Cl)nc2ccccc12)=O

InChI

InChI=1S/C23H18ClF3N4O2S/c24-17-10-8-15(9-11-17)21-30-20-7-2-1-6-19(20)22(31-21)28-12-13-29-34(32,33)18-5-3-4-16(14-18)23(25,26)27/h1-11,14,29H,12-13H2,(H,28,30,31)

InChI Key

QIGMUSSFZSEKFC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19787376

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

506.94

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.597

Distribution Coefficient, logD

6.331

Water Solubility, LogSw

-6.81

Polar Surface Area

70.840

Acid Dissociation Constant (pKa)

10.99

Base Dissociation Constant (pKb)

7.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.00

V013-8463 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Glucocorticoid receptors Library (4806 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Akt-Targeted Library (14764 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Nuclear receptors
  • Others
  • Kinases
  • Phosphatases
Mechanism of action:
  • Receptor's ligands
  • Epigenetic

References: we are preparing a list of scientific research reports with V013-8463 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-8463?
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What is the minimum amount of V013-8463 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-8463
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-8463
  • 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 V013-8463 available by request