D360-7032 Screening compound: 2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-5-oxo-5,6,7,8-tetrahydroquinoline-3-carbonitrile

D360-7032 Screening compound: 2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-5-oxo-5,6,7,8-tetrahydroquinoline-3-carbonitrile
D360-7032 Screening compound: 2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-5-oxo-5,6,7,8-tetrahydroquinoline-3-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound D360-7032
2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-5-oxo-5,6,7,8-tetrahydroquinoline-3-carbonitrile

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

D360-7032

Molecular Formula

C18H13FN2O2S (C18 H13 FN2 O2 S)

Compound Name

2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-5-oxo-5,6,7,8-tetrahydroquinoline-3-carbonitrile

IUPAC name

2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-5-oxo-5678-tetrahydroquinoline-3-carbonitrile

SMILES

N#Cc1cc(C(CCC2)=O)c2nc1SCC(c(cc1)ccc1F)=O

InChI

InChI=1S/C18H13FN2O2S/c19-13-6-4-11(5-7-13)17(23)10-24-18-12(9-20)8-14-15(21-18)2-1-3-16(14)22/h4-8H,1-3,10H2

InChI Key

LZTGIIYCYSMCES-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14824601

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.38

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.418

Distribution Coefficient, logD

3.418

Water Solubility, LogSw

-3.99

Polar Surface Area

53.687

Acid Dissociation Constant (pKa)

18.20

Base Dissociation Constant (pKb)

-3.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

D360-7032 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D360-7032 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D360-7032?
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What is the minimum amount of D360-7032 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D360-7032
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D360-7032
  • 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 D360-7032 available by request