F978-0226 Screening compound: ethyl 2-({4-[1-(4-fluorophenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperazine-1-carbonyl}amino)acetate

F978-0226 Screening compound: ethyl 2-({4-[1-(4-fluorophenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperazine-1-carbonyl}amino)acetate
F978-0226 Screening compound: ethyl 2-({4-[1-(4-fluorophenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperazine-1-carbonyl}amino)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound F978-0226
ethyl 2-({4-[1-(4-fluorophenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperazine-1-carbonyl}amino)acetate

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

F978-0226

Molecular Formula

C19H22FN5O4 (C19 H22 FN5 O4)

Compound Name

ethyl 2-({4-[1-(4-fluorophenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperazine-1-carbonyl}amino)acetate

IUPAC name

ethyl 2-({4-[1-(4-fluorophenyl)-6-oxo-16-dihydropyridazin-3-yl]piperazine-1-carbonyl}amino)acetate

SMILES

CCOC(CNC(N(CC1)CCN1C(C=C1)=NN(c(cc2)ccc2F)C1=O)=O)=O

InChI

InChI=1S/C19H22FN5O4/c1-2-29-18(27)13-21-19(28)24-11-9-23(10-12-24)16-7-8-17(26)25(22-16)15-5-3-14(20)4-6-15/h3-8H,2,9-13H2,1H3,(H,21,28)

InChI Key

MZYGOJYUOOZAOE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14973683

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.114

Distribution Coefficient, logD

1.113

Water Solubility, LogSw

-2.14

Polar Surface Area

77.734

Acid Dissociation Constant (pKa)

15.30

Base Dissociation Constant (pKb)

5.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.80

F978-0226 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F978-0226 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of F978-0226 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F978-0226
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F978-0226
  • 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 F978-0226 available by request