2816-1160 Screening compound: 4-[5-(4-chloro-3-nitrophenyl)furan-2-carbothioyl]morpholine

2816-1160 Screening compound: 4-[5-(4-chloro-3-nitrophenyl)furan-2-carbothioyl]morpholine
2816-1160 Screening compound: 4-[5-(4-chloro-3-nitrophenyl)furan-2-carbothioyl]morpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound 2816-1160
4-[5-(4-chloro-3-nitrophenyl)furan-2-carbothioyl]morpholine

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

2816-1160

Molecular Formula

C15H13ClN2O4S (C15 H13 ClN2 O4 S)

Compound Name

4-[5-(4-chloro-3-nitrophenyl)furan-2-carbothioyl]morpholine

IUPAC name

4-[5-(4-chloro-3-nitrophenyl)furan-2-carbothioyl]morpholine

SMILES

[O-][N+](c(cc(cc1)-c2ccc(C(N3CCOCC3)=S)o2)c1Cl)=O

InChI

InChI=1S/C15H13ClN2O4S/c16-11-2-1-10(9-12(11)18(19)20)13-3-4-14(22-13)15(23)17-5-7-21-8-6-17/h1-4,9H,5-8H2

InChI Key

NOWMAIRWSVFIGZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01933046

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

352.8

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.494

Distribution Coefficient, logD

3.494

Water Solubility, LogSw

-3.94

Polar Surface Area

51.575

Acid Dissociation Constant (pKa)

29.02

Base Dissociation Constant (pKb)

-2.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

2816-1160 in Drug Discovery

Included in Screening Libraries

Human Kinases Annotated Library (2415 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 2816-1160 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2816-1160?
Check Price and Availability of 2816-1160, 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 2816-1160 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2816-1160
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2816-1160
  • 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 2816-1160 available by request