Y040-4212 Screening compound: N-(4-methylphenyl)-2-[(3,4,7-trimethyl-2-oxo-2H-chromen-5-yl)oxy]acetamide

Y040-4212 Screening compound: N-(4-methylphenyl)-2-[(3,4,7-trimethyl-2-oxo-2H-chromen-5-yl)oxy]acetamide
Y040-4212 Screening compound: N-(4-methylphenyl)-2-[(3,4,7-trimethyl-2-oxo-2H-chromen-5-yl)oxy]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-4212
N-(4-methylphenyl)-2-[(3,4,7-trimethyl-2-oxo-2H-chromen-5-yl)oxy]acetamide

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

Y040-4212

Molecular Formula

C21H21NO4 (C21 H21 NO4)

Compound Name

N-(4-methylphenyl)-2-[(3,4,7-trimethyl-2-oxo-2H-chromen-5-yl)oxy]acetamide

IUPAC name

N-(4-methylphenyl)-2-[(347-trimethyl-2-oxo-2H-chromen-5-yl)oxy]acetamide

SMILES

Cc(cc1)ccc1NC(COc1cc(C)cc(O2)c1C(C)=C(C)C2=O)=O

InChI

InChI=1S/C21H21NO4/c1-12-5-7-16(8-6-12)22-19(23)11-25-17-9-13(2)10-18-20(17)14(3)15(4)21(24)26-18/h5-10H,11H2,1-4H3,(H,22,23)

InChI Key

HUJJJQSUKMRTDX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05989643

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.630

Distribution Coefficient, logD

4.630

Water Solubility, LogSw

-4.63

Polar Surface Area

51.624

Acid Dissociation Constant (pKa)

12.64

Base Dissociation Constant (pKb)

2.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

References: we are preparing a list of scientific research reports with Y040-4212 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-4212?
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What is the minimum amount of Y040-4212 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-4212
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-4212
  • 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 Y040-4212 available by request