4270-0425 Screening compound: 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl propanoate

4270-0425 Screening compound: 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl propanoate
4270-0425 Screening compound: 3-chloro-4-methyl-2-oxo-2H-chromen-7-yl propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4270-0425
3-chloro-4-methyl-2-oxo-2H-chromen-7-yl propanoate

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

4270-0425

Molecular Formula

C13H11ClO4 (C13 H11 ClO4)

Compound Name

3-chloro-4-methyl-2-oxo-2H-chromen-7-yl propanoate

IUPAC name

3-chloro-4-methyl-2-oxo-2H-chromen-7-yl propanoate

SMILES

CCC(Oc(cc1)cc(OC2=O)c1C(C)=C2Cl)=O

InChI

InChI=1S/C13H11ClO4/c1-3-11(15)17-8-4-5-9-7(2)12(14)13(16)18-10(9)6-8/h4-6H,3H2,1-2H3

InChI Key

JQYIXGWWNDPQCL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02108767

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

266.68

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.809

Distribution Coefficient, logD

2.809

Water Solubility, LogSw

-3.33

Polar Surface Area

41.214

Acid Dissociation Constant (pKa)

22.14

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

4270-0425 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4270-0425 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4270-0425?
Check Price and Availability of 4270-0425, 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 4270-0425 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4270-0425
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4270-0425
  • 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 4270-0425 available by request