5754-2923 Screening compound: N-[5-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)-2-(piperidin-1-yl)phenyl]benzenesulfonamide

5754-2923 Screening compound: N-[5-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)-2-(piperidin-1-yl)phenyl]benzenesulfonamide
5754-2923 Screening compound: N-[5-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)-2-(piperidin-1-yl)phenyl]benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5754-2923
N-[5-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)-2-(piperidin-1-yl)phenyl]benzenesulfonamide

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

5754-2923

Molecular Formula

C26H26N4O3S (C26 H26 N4 O3 S)

Compound Name

N-[5-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)-2-(piperidin-1-yl)phenyl]benzenesulfonamide

IUPAC name

N-[5-(3-methyl-4-oxo-34-dihydrophthalazin-1-yl)-2-(piperidin-1-yl)phenyl]benzenesulfonamide

SMILES

CN1N=C(c(cc2)cc(NS(c3ccccc3)(=O)=O)c2N2CCCCC2)c(cccc2)c2C1=O

InChI

InChI=1S/C26H26N4O3S/c1-29-26(31)22-13-7-6-12-21(22)25(27-29)19-14-15-24(30-16-8-3-9-17-30)23(18-19)28-34(32,33)20-10-4-2-5-11-20/h2,4-7,10-15,18,28H,3,8-9,16-17H2,1H3

InChI Key

WOWQRPZZKIZYMC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03673245

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.58

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.361

Distribution Coefficient, logD

3.141

Water Solubility, LogSw

-4.16

Polar Surface Area

70.249

Acid Dissociation Constant (pKa)

6.21

Base Dissociation Constant (pKb)

4.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

5754-2923 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-infective Library (19449 compounds)

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

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with 5754-2923 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5754-2923?
Check Price and Availability of 5754-2923, 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 5754-2923 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5754-2923
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5754-2923
  • 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 5754-2923 available by request