4406-0064 Screening compound: N,N-dibenzyl-8-methoxy-2-oxo-2H-chromene-3-carboxamide

4406-0064 Screening compound: N,N-dibenzyl-8-methoxy-2-oxo-2H-chromene-3-carboxamide
4406-0064 Screening compound: N,N-dibenzyl-8-methoxy-2-oxo-2H-chromene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4406-0064
N,N-dibenzyl-8-methoxy-2-oxo-2H-chromene-3-carboxamide

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

4406-0064

Molecular Formula

C25H21NO4 (C25 H21 NO4)

Compound Name

N,N-dibenzyl-8-methoxy-2-oxo-2H-chromene-3-carboxamide

IUPAC name

NN-dibenzyl-8-methoxy-2-oxo-2H-chromene-3-carboxamide

SMILES

COc(cccc1C=C2C(N(Cc3ccccc3)Cc3ccccc3)=O)c1OC2=O

InChI

InChI=1S/C25H21NO4/c1-29-22-14-8-13-20-15-21(25(28)30-23(20)22)24(27)26(16-18-9-4-2-5-10-18)17-19-11-6-3-7-12-19/h2-15H,16-17H2,1H3

InChI Key

WWORSFFZDLLLKJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03039680

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.45

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

4.010

Distribution Coefficient, logD

4.010

Water Solubility, LogSw

-4.42

Polar Surface Area

44.414

Acid Dissociation Constant (pKa)

27.39

Base Dissociation Constant (pKb)

-4.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.00

References: we are preparing a list of scientific research reports with 4406-0064 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4406-0064?
Check Price and Availability of 4406-0064, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 4406-0064 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4406-0064
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4406-0064
  • 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 4406-0064 available by request