Y041-1991 Screening compound: 7-(2,4-dinitrophenoxy)-3-(3-methoxyphenoxy)-2-methyl-4H-chromen-4-one

Y041-1991 Screening compound: 7-(2,4-dinitrophenoxy)-3-(3-methoxyphenoxy)-2-methyl-4H-chromen-4-one
Y041-1991 Screening compound: 7-(2,4-dinitrophenoxy)-3-(3-methoxyphenoxy)-2-methyl-4H-chromen-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y041-1991
7-(2,4-dinitrophenoxy)-3-(3-methoxyphenoxy)-2-methyl-4H-chromen-4-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

Y041-1991

Molecular Formula

C23H16N2O9 (C23 H16 N2 O9)

Compound Name

7-(2,4-dinitrophenoxy)-3-(3-methoxyphenoxy)-2-methyl-4H-chromen-4-one

IUPAC name

7-(24-dinitrophenoxy)-3-(3-methoxyphenoxy)-2-methyl-4H-chromen-4-one

SMILES

CC(Oc(cc(cc1)Oc(ccc([N+]([O-])=O)c2)c2[N+]([O-])=O)c1C1=O)=C1Oc1cc(OC)ccc1

InChI

InChI=1S/C23H16N2O9/c1-13-23(34-16-5-3-4-15(11-16)31-2)22(26)18-8-7-17(12-21(18)32-13)33-20-9-6-14(24(27)28)10-19(20)25(29)30/h3-12H,1-2H3

InChI Key

KXJKRLVLFSPMCM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01550812

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

464.39

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

4.603

Distribution Coefficient, logD

4.603

Water Solubility, LogSw

-4.65

Polar Surface Area

108.503

Acid Dissociation Constant (pKa)

31.81

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

References: we are preparing a list of scientific research reports with Y041-1991 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y041-1991?
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What is the minimum amount of Y041-1991 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y041-1991
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y041-1991
  • 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 Y041-1991 available by request