Y040-7099 Screening compound: ethyl 2-({3-methyl-6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-1-yl}oxy)propanoate

Y040-7099 Screening compound: ethyl 2-({3-methyl-6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-1-yl}oxy)propanoate
Y040-7099 Screening compound: ethyl 2-({3-methyl-6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-1-yl}oxy)propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-7099
ethyl 2-({3-methyl-6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-1-yl}oxy)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

Y040-7099

Molecular Formula

C19H22O5 (C19 H22 O5)

Compound Name

ethyl 2-({3-methyl-6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-1-yl}oxy)propanoate

IUPAC name

ethyl 2-({3-methyl-6-oxo-6H7H8H9H10H-cyclohexa[c]chromen-1-yl}oxy)propanoate

SMILES

CCOC(C(C)Oc1cc(C)cc(O2)c1C(CCCC1)=C1C2=O)=O

InChI

InChI=1S/C19H22O5/c1-4-22-18(20)12(3)23-15-9-11(2)10-16-17(15)13-7-5-6-8-14(13)19(21)24-16/h9-10,12H,4-8H2,1-3H3/t12-/m0/s1

InChI Key

ANHIFGOUEWFZKJ-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD02081242

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.38

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.259

Distribution Coefficient, logD

4.259

Water Solubility, LogSw

-4.34

Polar Surface Area

48.710

Acid Dissociation Constant (pKa)

22.48

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.40

Y040-7099 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y040-7099 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-7099?
Check Price and Availability of Y040-7099, 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 Y040-7099 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-7099
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-7099
  • 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 Y040-7099 available by request