D153-0017 Screening compound: 2-phenyl-6-{1-[4-(trifluoromethoxy)benzenesulfonyl]piperidin-4-yl}-2,3-dihydropyridazin-3-one

D153-0017 Screening compound: 2-phenyl-6-{1-[4-(trifluoromethoxy)benzenesulfonyl]piperidin-4-yl}-2,3-dihydropyridazin-3-one
D153-0017 Screening compound: 2-phenyl-6-{1-[4-(trifluoromethoxy)benzenesulfonyl]piperidin-4-yl}-2,3-dihydropyridazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D153-0017
2-phenyl-6-{1-[4-(trifluoromethoxy)benzenesulfonyl]piperidin-4-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

D153-0017

Molecular Formula

C22H20F3N3O4S (C22 H20 F3 N3 O4 S)

Compound Name

2-phenyl-6-{1-[4-(trifluoromethoxy)benzenesulfonyl]piperidin-4-yl}-2,3-dihydropyridazin-3-one

IUPAC name

2-phenyl-6-{1-[4-(trifluoromethoxy)benzenesulfonyl]piperidin-4-yl}-23-dihydropyridazin-3-one

SMILES

O=C1N(c2ccccc2)N=C(C(CC2)CCN2S(c(cc2)ccc2OC(F)(F)F)(=O)=O)C=C1

InChI

InChI=1S/C22H20F3N3O4S/c23-22(24,25)32-18-6-8-19(9-7-18)33(30,31)27-14-12-16(13-15-27)20-10-11-21(29)28(26-20)17-4-2-1-3-5-17/h1-11,16H,12-15H2

InChI Key

SYBPXMIPXUIMFI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14812930

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.48

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.690

Distribution Coefficient, logD

4.690

Water Solubility, LogSw

-4.65

Polar Surface Area

64.776

Acid Dissociation Constant (pKa)

27.95

Base Dissociation Constant (pKb)

-8.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

D153-0017 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D153-0017 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D153-0017?
Check Price and Availability of D153-0017, 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 D153-0017 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D153-0017
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D153-0017
  • 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 D153-0017 available by request