T424-0815 Screening compound: 2-benzyl-5-{3-[4-(4-fluorophenyl)piperazine-1-carbonyl]piperidin-1-yl}-2,3-dihydropyridazin-3-one

T424-0815 Screening compound: 2-benzyl-5-{3-[4-(4-fluorophenyl)piperazine-1-carbonyl]piperidin-1-yl}-2,3-dihydropyridazin-3-one
T424-0815 Screening compound: 2-benzyl-5-{3-[4-(4-fluorophenyl)piperazine-1-carbonyl]piperidin-1-yl}-2,3-dihydropyridazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound T424-0815
2-benzyl-5-{3-[4-(4-fluorophenyl)piperazine-1-carbonyl]piperidin-1-yl}-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

T424-0815

Molecular Formula

C27H30FN5O2 (C27 H30 FN5 O2)

Compound Name

2-benzyl-5-{3-[4-(4-fluorophenyl)piperazine-1-carbonyl]piperidin-1-yl}-2,3-dihydropyridazin-3-one

IUPAC name

2-benzyl-5-{3-[4-(4-fluorophenyl)piperazine-1-carbonyl]piperidin-1-yl}-23-dihydropyridazin-3-one

SMILES

O=C(C(CCC1)CN1C(C=NN1Cc2ccccc2)=CC1=O)N(CC1)CCN1c(cc1)ccc1F

InChI

InChI=1S/C27H30FN5O2/c28-23-8-10-24(11-9-23)30-13-15-31(16-14-30)27(35)22-7-4-12-32(20-22)25-17-26(34)33(29-18-25)19-21-5-2-1-3-6-21/h1-3,5-6,8-11,17-18,22H,4,7,12-16,19-20H2/t22-/m0/s1

InChI Key

RJHJBOXPPILOLU-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD29022571

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.57

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.150

Distribution Coefficient, logD

3.140

Water Solubility, LogSw

-3.12

Polar Surface Area

52.335

Acid Dissociation Constant (pKa)

22.98

Base Dissociation Constant (pKb)

5.78

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.00

References: we are preparing a list of scientific research reports with T424-0815 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T424-0815?
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What is the minimum amount of T424-0815 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T424-0815
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T424-0815
  • 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 T424-0815 available by request