D144-1114 Screening compound: 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)-N-(2-phenylethyl)propanamide

D144-1114 Screening compound: 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)-N-(2-phenylethyl)propanamide
D144-1114 Screening compound: 3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)-N-(2-phenylethyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D144-1114
3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)-N-(2-phenylethyl)propanamide

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

D144-1114

Molecular Formula

C22H23NO4 (C22 H23 NO4)

Compound Name

3-(7-hydroxy-4,8-dimethyl-2-oxo-2H-chromen-3-yl)-N-(2-phenylethyl)propanamide

IUPAC name

3-(7-hydroxy-48-dimethyl-2-oxo-2H-chromen-3-yl)-N-(2-phenylethyl)propanamide

SMILES

Cc(c(O1)c(cc2)C(C)=C(CCC(NCCc3ccccc3)=O)C1=O)c2O

InChI

InChI=1S/C22H23NO4/c1-14-17-8-10-19(24)15(2)21(17)27-22(26)18(14)9-11-20(25)23-13-12-16-6-4-3-5-7-16/h3-8,10,24H,9,11-13H2,1-2H3,(H,23,25)

InChI Key

NFPXOBRNHIOGMB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06439718

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.963

Distribution Coefficient, logD

2.959

Water Solubility, LogSw

-3.30

Polar Surface Area

61.434

Acid Dissociation Constant (pKa)

9.38

Base Dissociation Constant (pKb)

-1.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

D144-1114 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D144-1114 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D144-1114?
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What is the minimum amount of D144-1114 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D144-1114
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D144-1114
  • 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 D144-1114 available by request