4169-2549 Screening compound: 8-{[5-(4-METHANESULFONYLPIPERAZIN-1-YL)-2-NITROPHENYL]SULFANYL}QUINOLINE

4169-2549 Screening compound: 8-{[5-(4-METHANESULFONYLPIPERAZIN-1-YL)-2-NITROPHENYL]SULFANYL}QUINOLINE
4169-2549 Screening compound: 8-{[5-(4-METHANESULFONYLPIPERAZIN-1-YL)-2-NITROPHENYL]SULFANYL}QUINOLINE alternative view

Chemical Structure Depiction of ChemDiv screening compound 4169-2549
8-{[5-(4-METHANESULFONYLPIPERAZIN-1-YL)-2-NITROPHENYL]SULFANYL}QUINOLINE

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

4169-2549

Molecular Formula

C20H20N4O4S2 (C20 H20 N4 O4 S2)

Compound Name

8-{[5-(4-METHANESULFONYLPIPERAZIN-1-YL)-2-NITROPHENYL]SULFANYL}QUINOLINE

IUPAC name

n/a

SMILES

CS(N(CC1)CCN1c(cc1)cc(Sc2cccc3cccnc23)c1[N+]([O-])=O)(=O)=O

InChI

InChI=1S/C20H20N4O4S2/c1-30(27,28)23-12-10-22(11-13-23)16-7-8-17(24(25)26)19(14-16)29-18-6-2-4-15-5-3-9-21-20(15)18/h2-9,14H,10-13H2,1H3

InChI Key

SRKZIYSEAQIBBT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02218104

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.54

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.114

Distribution Coefficient, logD

3.111

Water Solubility, LogSw

-3.41

Polar Surface Area

77.316

Acid Dissociation Constant (pKa)

24.48

Base Dissociation Constant (pKb)

5.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.00

4169-2549 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 4169-2549 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4169-2549?
Check Price and Availability of 4169-2549, 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 4169-2549 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4169-2549
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4169-2549
  • 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 4169-2549 available by request