C723-0449 Screening compound: 1-(benzyloxy)-N-[3,5-bis(trifluoromethyl)phenyl]-2-oxo-1,2-dihydropyridine-3-carboxamide

C723-0449 Screening compound: 1-(benzyloxy)-N-[3,5-bis(trifluoromethyl)phenyl]-2-oxo-1,2-dihydropyridine-3-carboxamide
C723-0449 Screening compound: 1-(benzyloxy)-N-[3,5-bis(trifluoromethyl)phenyl]-2-oxo-1,2-dihydropyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C723-0449
1-(benzyloxy)-N-[3,5-bis(trifluoromethyl)phenyl]-2-oxo-1,2-dihydropyridine-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

C723-0449

Molecular Formula

C21H14F6N2O3 (C21 H14 F6 N2 O3)

Compound Name

1-(benzyloxy)-N-[3,5-bis(trifluoromethyl)phenyl]-2-oxo-1,2-dihydropyridine-3-carboxamide

IUPAC name

1-(benzyloxy)-N-[35-bis(trifluoromethyl)phenyl]-2-oxo-12-dihydropyridine-3-carboxamide

SMILES

O=C(C(C1=O)=CC=CN1OCc1ccccc1)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1

InChI

InChI=1S/C21H14F6N2O3/c22-20(23,24)14-9-15(21(25,26)27)11-16(10-14)28-18(30)17-7-4-8-29(19(17)31)32-12-13-5-2-1-3-6-13/h1-11H,12H2,(H,28,30)

InChI Key

XUBBTZXLRSRNHN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04472658

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.155

Distribution Coefficient, logD

1.823

Water Solubility, LogSw

-5.49

Polar Surface Area

49.264

Acid Dissociation Constant (pKa)

4.07

Base Dissociation Constant (pKb)

-1.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

References: we are preparing a list of scientific research reports with C723-0449 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C723-0449?
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What is the minimum amount of C723-0449 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C723-0449
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C723-0449
  • 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 C723-0449 available by request