Y040-0987 Screening compound: 2-[(6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]-N,N-diethylacetamide

Y040-0987 Screening compound: 2-[(6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]-N,N-diethylacetamide
Y040-0987 Screening compound: 2-[(6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]-N,N-diethylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-0987
2-[(6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]-N,N-diethylacetamide

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

Y040-0987

Molecular Formula

C21H20ClNO4 (C21 H20 ClNO4)

Compound Name

2-[(6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]-N,N-diethylacetamide

IUPAC name

2-[(6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]-NN-diethylacetamide

SMILES

CCN(CC)C(COc(cc(c(C(c1ccccc1)=C1)c2)OC1=O)c2Cl)=O

InChI

InChI=1S/C21H20ClNO4/c1-3-23(4-2)20(24)13-26-19-12-18-16(10-17(19)22)15(11-21(25)27-18)14-8-6-5-7-9-14/h5-12H,3-4,13H2,1-2H3

InChI Key

MZUSXMIVRBKAIY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03029585

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.85

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.653

Distribution Coefficient, logD

3.653

Water Solubility, LogSw

-4.21

Polar Surface Area

43.365

Acid Dissociation Constant (pKa)

25.23

Base Dissociation Constant (pKb)

0.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

References: we are preparing a list of scientific research reports with Y040-0987 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-0987?
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What is the minimum amount of Y040-0987 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-0987
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-0987
  • 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 Y040-0987 available by request