Y040-1005 Screening compound: methyl 2-[(6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]-2-phenylacetate

Y040-1005 Screening compound: methyl 2-[(6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]-2-phenylacetate
Y040-1005 Screening compound: methyl 2-[(6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]-2-phenylacetate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-1005
methyl 2-[(6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]-2-phenylacetate

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

Y040-1005

Molecular Formula

C24H17ClO5 (C24 H17 ClO5)

Compound Name

methyl 2-[(6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]-2-phenylacetate

IUPAC name

methyl 2-[(6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]-2-phenylacetate

SMILES

COC(C(c1ccccc1)Oc(cc(c(C(c1ccccc1)=C1)c2)OC1=O)c2Cl)=O

InChI

InChI=1S/C24H17ClO5/c1-28-24(27)23(16-10-6-3-7-11-16)30-21-14-20-18(12-19(21)25)17(13-22(26)29-20)15-8-4-2-5-9-15/h2-14,23H,1H3/t23-/m1/s1

InChI Key

MHZCURLOTNGKFR-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD06763466

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.85

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.451

Distribution Coefficient, logD

5.451

Water Solubility, LogSw

-6.07

Polar Surface Area

48.139

Acid Dissociation Constant (pKa)

20.38

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

8.30

Y040-1005 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Antimitotic Tubulin Library (17355 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro

References: we are preparing a list of scientific research reports with Y040-1005 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-1005?
Check Price and Availability of Y040-1005, 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 Y040-1005 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-1005
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-1005
  • 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 Y040-1005 available by request