C301-3446 Screening compound: 2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-[4-(furan-2-carbonyl)piperazin-1-yl]quinoxaline

C301-3446 Screening compound: 2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-[4-(furan-2-carbonyl)piperazin-1-yl]quinoxaline
C301-3446 Screening compound: 2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-[4-(furan-2-carbonyl)piperazin-1-yl]quinoxaline alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-3446
2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-[4-(furan-2-carbonyl)piperazin-1-yl]quinoxaline

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

C301-3446

Molecular Formula

C22H22N6O2 (C22 H22 N6 O2)

Compound Name

2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-[4-(furan-2-carbonyl)piperazin-1-yl]quinoxaline

IUPAC name

2-(35-dimethyl-1H-pyrazol-1-yl)-3-[4-(furan-2-carbonyl)piperazin-1-yl]quinoxaline

SMILES

Cc1cc(C)nn1-c1nc2ccccc2nc1N(CC1)CCN1C(c1ccco1)=O

InChI

InChI=1S/C22H22N6O2/c1-15-14-16(2)28(25-15)21-20(23-17-6-3-4-7-18(17)24-21)26-9-11-27(12-10-26)22(29)19-8-5-13-30-19/h3-8,13-14H,9-12H2,1-2H3

InChI Key

SBBFOTWGYCKSDY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14743129

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.036

Distribution Coefficient, logD

3.036

Water Solubility, LogSw

-2.99

Polar Surface Area

59.396

Acid Dissociation Constant (pKa)

24.42

Base Dissociation Constant (pKb)

4.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

C301-3446 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

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

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C301-3446 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-3446?
Check Price and Availability of C301-3446, 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 C301-3446 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-3446
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-3446
  • 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 C301-3446 available by request