6392-0334 Screening compound: (2E)-3-[2-(2-fluorophenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-(4-methylbenzenesulfonyl)prop-2-enenitrile

6392-0334 Screening compound: (2E)-3-[2-(2-fluorophenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-(4-methylbenzenesulfonyl)prop-2-enenitrile
6392-0334 Screening compound: (2E)-3-[2-(2-fluorophenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-(4-methylbenzenesulfonyl)prop-2-enenitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 6392-0334
(2E)-3-[2-(2-fluorophenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-(4-methylbenzenesulfonyl)prop-2-enenitrile

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

6392-0334

Molecular Formula

C24H16FN3O4S (C24 H16 FN3 O4 S)

Compound Name

(2E)-3-[2-(2-fluorophenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-(4-methylbenzenesulfonyl)prop-2-enenitrile

IUPAC name

(2E)-3-[2-(2-fluorophenoxy)-4-oxo-4H-pyrido[12-a]pyrimidin-3-yl]-2-(4-methylbenzenesulfonyl)prop-2-enenitrile

SMILES

Cc(cc1)ccc1S(/C(/C#N)=C/C(C(N(C=CC=C1)C1=N1)=O)=C1Oc(cccc1)c1F)(=O)=O

InChI

InChI=1S/C24H16FN3O4S/c1-16-9-11-17(12-10-16)33(30,31)18(15-26)14-19-23(32-21-7-3-2-6-20(21)25)27-22-8-4-5-13-28(22)24(19)29/h2-14H,1H3

InChI Key

UVEDXWOLBZWYMR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04186394

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.47

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.801

Distribution Coefficient, logD

3.801

Water Solubility, LogSw

-4.06

Polar Surface Area

79.386

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

-1.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.20

6392-0334 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

KRAS-Targeted Library (16000 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Agro:
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 6392-0334 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6392-0334?
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What is the minimum amount of 6392-0334 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6392-0334
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6392-0334
  • 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 6392-0334 available by request