Y040-7965 Screening compound: methyl 4-({[6-chloro-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-2H-chromen-7-yl]oxy}methyl)benzoate

Y040-7965 Screening compound: methyl 4-({[6-chloro-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-2H-chromen-7-yl]oxy}methyl)benzoate
Y040-7965 Screening compound: methyl 4-({[6-chloro-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-2H-chromen-7-yl]oxy}methyl)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-7965
methyl 4-({[6-chloro-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-2H-chromen-7-yl]oxy}methyl)benzoate

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

Y040-7965

Molecular Formula

C22H19ClO7 (C22 H19 ClO7)

Compound Name

methyl 4-({[6-chloro-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-2H-chromen-7-yl]oxy}methyl)benzoate

IUPAC name

methyl 4-({[6-chloro-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-2H-chromen-7-yl]oxy}methyl)benzoate

SMILES

CC(c(c(O1)c2)cc(Cl)c2OCc(cc2)ccc2C(OC)=O)=C(CC(OC)=O)C1=O

InChI

InChI=1S/C22H19ClO7/c1-12-15-8-17(23)19(10-18(15)30-22(26)16(12)9-20(24)27-2)29-11-13-4-6-14(7-5-13)21(25)28-3/h4-8,10H,9,11H2,1-3H3

InChI Key

PMQCBIQGMGMOJM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03852122

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

430.84

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.650

Distribution Coefficient, logD

4.650

Water Solubility, LogSw

-4.92

Polar Surface Area

70.227

Acid Dissociation Constant (pKa)

21.25

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

References: we are preparing a list of scientific research reports with Y040-7965 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-7965?
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What is the minimum amount of Y040-7965 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-7965
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-7965
  • 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 Y040-7965 available by request