C301-8648 Screening compound: N-[4-(ethylamino)-2-oxo-2H-chromen-3-yl]-2-(4-methylphenoxy)acetamide

C301-8648 Screening compound: N-[4-(ethylamino)-2-oxo-2H-chromen-3-yl]-2-(4-methylphenoxy)acetamide
C301-8648 Screening compound: N-[4-(ethylamino)-2-oxo-2H-chromen-3-yl]-2-(4-methylphenoxy)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-8648
N-[4-(ethylamino)-2-oxo-2H-chromen-3-yl]-2-(4-methylphenoxy)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

C301-8648

Molecular Formula

C20H20N2O4 (C20 H20 N2 O4)

Compound Name

N-[4-(ethylamino)-2-oxo-2H-chromen-3-yl]-2-(4-methylphenoxy)acetamide

IUPAC name

N-[4-(ethylamino)-2-oxo-2H-chromen-3-yl]-2-(4-methylphenoxy)acetamide

SMILES

CCNC(c(cccc1)c1OC1=O)=C1NC(COc1ccc(C)cc1)=O

InChI

InChI=1S/C20H20N2O4/c1-3-21-18-15-6-4-5-7-16(15)26-20(24)19(18)22-17(23)12-25-14-10-8-13(2)9-11-14/h4-11,21H,3,12H2,1-2H3,(H,22,23)

InChI Key

XDNUVAOGFXPDRK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14745580

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

352.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.766

Distribution Coefficient, logD

2.726

Water Solubility, LogSw

-3.44

Polar Surface Area

62.067

Acid Dissociation Constant (pKa)

8.51

Base Dissociation Constant (pKb)

5.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

C301-8648 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with C301-8648 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-8648?
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What is the minimum amount of C301-8648 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-8648
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-8648
  • 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 C301-8648 available by request