C301-4888 Screening compound: N-(3-ethylphenyl)-[1,2,4]triazolo[4,3-c]quinazolin-5-amine

C301-4888 Screening compound: N-(3-ethylphenyl)-[1,2,4]triazolo[4,3-c]quinazolin-5-amine
C301-4888 Screening compound: N-(3-ethylphenyl)-[1,2,4]triazolo[4,3-c]quinazolin-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-4888
N-(3-ethylphenyl)-[1,2,4]triazolo[4,3-c]quinazolin-5-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

C301-4888

Molecular Formula

C17H15N5 (C17 H15 N5)

Compound Name

N-(3-ethylphenyl)-[1,2,4]triazolo[4,3-c]quinazolin-5-amine

IUPAC name

N-(3-ethylphenyl)-[124]triazolo[43-c]quinazolin-5-amine

SMILES

CCc1cccc(Nc2nc(cccc3)c3c3nncn23)c1

InChI

InChI=1S/C17H15N5/c1-2-12-6-5-7-13(10-12)19-17-20-15-9-4-3-8-14(15)16-21-18-11-22(16)17/h3-11H,2H2,1H3,(H,19,20)

InChI Key

WEXXYKKWMPXDDM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14743776

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

289.34

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.702

Distribution Coefficient, logD

3.634

Water Solubility, LogSw

-4.06

Polar Surface Area

41.697

Acid Dissociation Constant (pKa)

18.82

Base Dissociation Constant (pKb)

6.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

C301-4888 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anticancer Library (62698 compounds)

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

Protein Kinases Inhibitors Library (36801 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Targets:
  • Kinases
  • Ion Channels

References: we are preparing a list of scientific research reports with C301-4888 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-4888?
Check Price and Availability of C301-4888, 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 C301-4888 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-4888
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-4888
  • 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 C301-4888 available by request