Y070-0105 Screening compound: 3-(4-chlorophenoxy)-2-methyl-4-oxo-4H-chromen-7-yl acetate

Y070-0105 Screening compound: 3-(4-chlorophenoxy)-2-methyl-4-oxo-4H-chromen-7-yl acetate
Y070-0105 Screening compound: 3-(4-chlorophenoxy)-2-methyl-4-oxo-4H-chromen-7-yl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y070-0105
3-(4-chlorophenoxy)-2-methyl-4-oxo-4H-chromen-7-yl acetate

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

Y070-0105

Molecular Formula

C18H13ClO5 (C18 H13 ClO5)

Compound Name

3-(4-chlorophenoxy)-2-methyl-4-oxo-4H-chromen-7-yl acetate

IUPAC name

3-(4-chlorophenoxy)-2-methyl-4-oxo-4H-chromen-7-yl acetate

SMILES

CC(Oc(cc1)cc(OC(C)=C2Oc(cc3)ccc3Cl)c1C2=O)=O

InChI

InChI=1S/C18H13ClO5/c1-10-18(24-13-5-3-12(19)4-6-13)17(21)15-8-7-14(23-11(2)20)9-16(15)22-10/h3-9H,1-2H3

InChI Key

RHILJJYQHLUIJZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00704177

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

344.75

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.658

Distribution Coefficient, logD

3.658

Water Solubility, LogSw

-4.01

Polar Surface Area

48.414

Acid Dissociation Constant (pKa)

22.67

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

Y070-0105 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with Y070-0105 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y070-0105?
Check Price and Availability of Y070-0105, 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 Y070-0105 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y070-0105
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y070-0105
  • 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 Y070-0105 available by request