F233-0481 Screening compound: 2-(4-fluorophenyl)-5-methoxy-6-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}-2,3-dihydropyridazin-3-one

F233-0481 Screening compound: 2-(4-fluorophenyl)-5-methoxy-6-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}-2,3-dihydropyridazin-3-one
F233-0481 Screening compound: 2-(4-fluorophenyl)-5-methoxy-6-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}-2,3-dihydropyridazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F233-0481
2-(4-fluorophenyl)-5-methoxy-6-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}-2,3-dihydropyridazin-3-one

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

F233-0481

Molecular Formula

C23H20F4N4O3 (C23 H20 F4 N4 O3)

Compound Name

2-(4-fluorophenyl)-5-methoxy-6-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}-2,3-dihydropyridazin-3-one

IUPAC name

2-(4-fluorophenyl)-5-methoxy-6-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}-23-dihydropyridazin-3-one

SMILES

COC(C(C(N(CC1)CCN1c1cc(C(F)(F)F)ccc1)=O)=NN1c(cc2)ccc2F)=CC1=O

InChI

InChI=1S/C23H20F4N4O3/c1-34-19-14-20(32)31(17-7-5-16(24)6-8-17)28-21(19)22(33)30-11-9-29(10-12-30)18-4-2-3-15(13-18)23(25,26)27/h2-8,13-14H,9-12H2,1H3

InChI Key

KOIIURFHKDEHMO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08536711

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.128

Distribution Coefficient, logD

3.128

Water Solubility, LogSw

-3.39

Polar Surface Area

53.740

Acid Dissociation Constant (pKa)

28.55

Base Dissociation Constant (pKb)

4.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

F233-0481 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F233-0481 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F233-0481?
Check Price and Availability of F233-0481, 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 F233-0481 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F233-0481
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F233-0481
  • 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 F233-0481 available by request