K979-0496 Screening compound: N-(2-fluorophenyl)-3-(3-methoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide

K979-0496 Screening compound: N-(2-fluorophenyl)-3-(3-methoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide
K979-0496 Screening compound: N-(2-fluorophenyl)-3-(3-methoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K979-0496
N-(2-fluorophenyl)-3-(3-methoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-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

K979-0496

Molecular Formula

C22H16FN3O3 (C22 H16 FN3 O3)

Compound Name

N-(2-fluorophenyl)-3-(3-methoxyphenyl)-4-oxo-3,4-dihydrophthalazine-1-carboxamide

IUPAC name

N-(2-fluorophenyl)-3-(3-methoxyphenyl)-4-oxo-34-dihydrophthalazine-1-carboxamide

SMILES

COc1cccc(N2N=C(C(Nc(cccc3)c3F)=O)c(cccc3)c3C2=O)c1

InChI

InChI=1S/C22H16FN3O3/c1-29-15-8-6-7-14(13-15)26-22(28)17-10-3-2-9-16(17)20(25-26)21(27)24-19-12-5-4-11-18(19)23/h2-13H,1H3,(H,24,27)

InChI Key

XYQXZSMJRVTRLL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15115814

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.875

Distribution Coefficient, logD

3.862

Water Solubility, LogSw

-4.14

Polar Surface Area

55.985

Acid Dissociation Constant (pKa)

8.92

Base Dissociation Constant (pKb)

1.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.50

References: we are preparing a list of scientific research reports with K979-0496 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K979-0496?
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What is the minimum amount of K979-0496 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K979-0496
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K979-0496
  • 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 K979-0496 available by request