F978-0671 Screening compound: N-(3-bromophenyl)-4-[1-(4-methylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperazine-1-carboxamide

F978-0671 Screening compound: N-(3-bromophenyl)-4-[1-(4-methylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperazine-1-carboxamide
F978-0671 Screening compound: N-(3-bromophenyl)-4-[1-(4-methylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F978-0671
N-(3-bromophenyl)-4-[1-(4-methylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperazine-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

F978-0671

Molecular Formula

C22H22BrN5O2 (C22 H22 BrN5 O2)

Compound Name

N-(3-bromophenyl)-4-[1-(4-methylphenyl)-6-oxo-1,6-dihydropyridazin-3-yl]piperazine-1-carboxamide

IUPAC name

N-(3-bromophenyl)-4-[1-(4-methylphenyl)-6-oxo-16-dihydropyridazin-3-yl]piperazine-1-carboxamide

SMILES

Cc(cc1)ccc1N(C(C=C1)=O)N=C1N(CC1)CCN1C(Nc1cccc(Br)c1)=O

InChI

InChI=1S/C22H22BrN5O2/c1-16-5-7-19(8-6-16)28-21(29)10-9-20(25-28)26-11-13-27(14-12-26)22(30)24-18-4-2-3-17(23)15-18/h2-10,15H,11-14H2,1H3,(H,24,30)

InChI Key

BRUFKTIWIREGSQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27206683

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.35

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.867

Distribution Coefficient, logD

3.867

Water Solubility, LogSw

-3.89

Polar Surface Area

55.982

Acid Dissociation Constant (pKa)

12.15

Base Dissociation Constant (pKb)

3.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

References: we are preparing a list of scientific research reports with F978-0671 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F978-0671?
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What is the minimum amount of F978-0671 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F978-0671
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F978-0671
  • 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 F978-0671 available by request