Y040-7690 Screening compound: methyl 2-{[1-(2-methoxy-2-oxoethoxy)-6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-3-yl]oxy}acetate

Y040-7690 Screening compound: methyl 2-{[1-(2-methoxy-2-oxoethoxy)-6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-3-yl]oxy}acetate
Y040-7690 Screening compound: methyl 2-{[1-(2-methoxy-2-oxoethoxy)-6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-3-yl]oxy}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-7690
methyl 2-{[1-(2-methoxy-2-oxoethoxy)-6-oxo-6H,7H,8H,9H,10H-cyclohexa[c]chromen-3-yl]oxy}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

Y040-7690

Molecular Formula

C19H20O8 (C19 H20 O8)

Compound Name

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

IUPAC name

methyl 2-{[1-(2-methoxy-2-oxoethoxy)-6-oxo-6H7H8H9H10H-cyclohexa[c]chromen-3-yl]oxy}acetate

SMILES

COC(COc1cc(OC(C2=C3CCCC2)=O)c3c(OCC(OC)=O)c1)=O

InChI

InChI=1S/C19H20O8/c1-23-16(20)9-25-11-7-14(26-10-17(21)24-2)18-12-5-3-4-6-13(12)19(22)27-15(18)8-11/h7-8H,3-6,9-10H2,1-2H3

InChI Key

KQIAEQFFUDUWQQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01540195

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.36

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.767

Distribution Coefficient, logD

1.767

Water Solubility, LogSw

-1.77

Polar Surface Area

77.323

Acid Dissociation Constant (pKa)

24.27

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

Y040-7690 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with Y040-7690 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-7690?
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What is the minimum amount of Y040-7690 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-7690
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-7690
  • 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 Y040-7690 available by request