D400-5966 Screening compound: 1-[4-methoxy-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzenesulfonyl]-4-phenylpiperazine

D400-5966 Screening compound: 1-[4-methoxy-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzenesulfonyl]-4-phenylpiperazine
D400-5966 Screening compound: 1-[4-methoxy-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzenesulfonyl]-4-phenylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound D400-5966
1-[4-methoxy-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzenesulfonyl]-4-phenylpiperazine

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

D400-5966

Molecular Formula

C20H22N4O4S (C20 H22 N4 O4 S)

Compound Name

1-[4-methoxy-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzenesulfonyl]-4-phenylpiperazine

IUPAC name

1-[4-methoxy-3-(5-methyl-124-oxadiazol-3-yl)benzenesulfonyl]-4-phenylpiperazine

SMILES

Cc1nc(-c(cc(cc2)S(N(CC3)CCN3c3ccccc3)(=O)=O)c2OC)no1

InChI

InChI=1S/C20H22N4O4S/c1-15-21-20(22-28-15)18-14-17(8-9-19(18)27-2)29(25,26)24-12-10-23(11-13-24)16-6-4-3-5-7-16/h3-9,14H,10-13H2,1-2H3

InChI Key

CWLNXMNBNWLBHX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14827601

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.49

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.092

Distribution Coefficient, logD

3.092

Water Solubility, LogSw

-3.38

Polar Surface Area

73.745

Acid Dissociation Constant (pKa)

27.94

Base Dissociation Constant (pKb)

2.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

D400-5966 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D400-5966 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D400-5966?
Check Price and Availability of D400-5966, 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 D400-5966 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D400-5966
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D400-5966
  • 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 D400-5966 available by request