C301-3948 Screening compound: N-[3-(4-phenylpiperazine-1-carbonyl)phenyl]-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine

C301-3948 Screening compound: N-[3-(4-phenylpiperazine-1-carbonyl)phenyl]-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
C301-3948 Screening compound: N-[3-(4-phenylpiperazine-1-carbonyl)phenyl]-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-3948
N-[3-(4-phenylpiperazine-1-carbonyl)phenyl]-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine

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

C301-3948

Molecular Formula

C26H23N7O (C26 H23 N7 O)

Compound Name

N-[3-(4-phenylpiperazine-1-carbonyl)phenyl]-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine

IUPAC name

N-[3-(4-phenylpiperazine-1-carbonyl)phenyl]-[124]triazolo[43-a]quinoxalin-4-amine

SMILES

O=C(c1cc(Nc2nc(cccc3)c3n3c2nnc3)ccc1)N(CC1)CCN1c1ccccc1

InChI

InChI=1S/C26H23N7O/c34-26(32-15-13-31(14-16-32)21-9-2-1-3-10-21)19-7-6-8-20(17-19)28-24-25-30-27-18-33(25)23-12-5-4-11-22(23)29-24/h1-12,17-18H,13-16H2,(H,28,29)

InChI Key

STMUGCLAJPGSBP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14743346

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.505

Distribution Coefficient, logD

3.500

Water Solubility, LogSw

-3.70

Polar Surface Area

59.987

Acid Dissociation Constant (pKa)

21.46

Base Dissociation Constant (pKb)

5.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

C301-3948 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Agro:
  • Agro
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C301-3948 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-3948?
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What is the minimum amount of C301-3948 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-3948
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-3948
  • 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 C301-3948 available by request