V013-3340 Screening compound: 2-fluoro-N~1~-[4-({4-[2-oxo-2-(1-pyrrolidinyl)ethyl]piperazino}carbonyl)-1,3-thiazol-2-yl]benzamide

V013-3340 Screening compound: 2-fluoro-N~1~-[4-({4-[2-oxo-2-(1-pyrrolidinyl)ethyl]piperazino}carbonyl)-1,3-thiazol-2-yl]benzamide
V013-3340 Screening compound: 2-fluoro-N~1~-[4-({4-[2-oxo-2-(1-pyrrolidinyl)ethyl]piperazino}carbonyl)-1,3-thiazol-2-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-3340
2-fluoro-N~1~-[4-({4-[2-oxo-2-(1-pyrrolidinyl)ethyl]piperazino}carbonyl)-1,3-thiazol-2-yl]benzamide

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

V013-3340

Molecular Formula

C21H24FN5O3S (C21 H24 FN5 O3 S)

Compound Name

2-fluoro-N~1~-[4-({4-[2-oxo-2-(1-pyrrolidinyl)ethyl]piperazino}carbonyl)-1,3-thiazol-2-yl]benzamide

IUPAC name

n/a

SMILES

O=C(CN(CC1)CCN1C(c1csc(NC(c(cccc2)c2F)=O)n1)=O)N1CCCC1

InChI

InChI=1S/C21H24FN5O3S/c22-16-6-2-1-5-15(16)19(29)24-21-23-17(14-31-21)20(30)27-11-9-25(10-12-27)13-18(28)26-7-3-4-8-26/h1-2,5-6,14H,3-4,7-13H2,(H,23,24,29)

InChI Key

OXKMCJBTELPWCF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19976438

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.722

Distribution Coefficient, logD

1.397

Water Solubility, LogSw

-2.75

Polar Surface Area

70.323

Acid Dissociation Constant (pKa)

7.35

Base Dissociation Constant (pKb)

5.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

V013-3340 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V013-3340 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-3340?
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What is the minimum amount of V013-3340 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-3340
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-3340
  • 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 V013-3340 available by request