Y040-2193 Screening compound: 3-[2-(3-fluoro-4-methoxyphenyl)-2-oxo-1-phenylethoxy]-6H,7H,8H,9H,10H-cyclohexa[c]chromen-6-one

Y040-2193 Screening compound: 3-[2-(3-fluoro-4-methoxyphenyl)-2-oxo-1-phenylethoxy]-6H,7H,8H,9H,10H-cyclohexa[c]chromen-6-one
Y040-2193 Screening compound: 3-[2-(3-fluoro-4-methoxyphenyl)-2-oxo-1-phenylethoxy]-6H,7H,8H,9H,10H-cyclohexa[c]chromen-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-2193
3-[2-(3-fluoro-4-methoxyphenyl)-2-oxo-1-phenylethoxy]-6H,7H,8H,9H,10H-cyclohexa[c]chromen-6-one

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

Y040-2193

Molecular Formula

C28H23FO5 (C28 H23 FO5)

Compound Name

3-[2-(3-fluoro-4-methoxyphenyl)-2-oxo-1-phenylethoxy]-6H,7H,8H,9H,10H-cyclohexa[c]chromen-6-one

IUPAC name

3-[2-(3-fluoro-4-methoxyphenyl)-2-oxo-1-phenylethoxy]-6H7H8H9H10H-cyclohexa[c]chromen-6-one

SMILES

COc(ccc(C(C(c1ccccc1)Oc(cc1)cc(O2)c1C(CCCC1)=C1C2=O)=O)c1)c1F

InChI

InChI=1S/C28H23FO5/c1-32-24-14-11-18(15-23(24)29)26(30)27(17-7-3-2-4-8-17)33-19-12-13-21-20-9-5-6-10-22(20)28(31)34-25(21)16-19/h2-4,7-8,11-16,27H,5-6,9-10H2,1H3/t27-/m1/s1

InChI Key

VCHPQBQIMYWHAQ-HHHXNRCGSA-N

MDL Number (MFCD)

MFCD02676902

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.49

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

6.084

Distribution Coefficient, logD

6.084

Water Solubility, LogSw

-5.53

Polar Surface Area

48.682

Acid Dissociation Constant (pKa)

18.17

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

21.40

Y040-2193 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 Y040-2193 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-2193?
Check Price and Availability of Y040-2193, 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 Y040-2193 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-2193
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-2193
  • 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 Y040-2193 available by request