C680-0562 Screening compound: 3-(3-methylphenyl)-N-[(4-methylphenyl)methyl]-[1,2,3]triazolo[1,5-a]quinazolin-5-amine

C680-0562 Screening compound: 3-(3-methylphenyl)-N-[(4-methylphenyl)methyl]-[1,2,3]triazolo[1,5-a]quinazolin-5-amine
C680-0562 Screening compound: 3-(3-methylphenyl)-N-[(4-methylphenyl)methyl]-[1,2,3]triazolo[1,5-a]quinazolin-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound C680-0562
3-(3-methylphenyl)-N-[(4-methylphenyl)methyl]-[1,2,3]triazolo[1,5-a]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

C680-0562

Molecular Formula

C24H21N5 (C24 H21 N5)

Compound Name

3-(3-methylphenyl)-N-[(4-methylphenyl)methyl]-[1,2,3]triazolo[1,5-a]quinazolin-5-amine

IUPAC name

3-(3-methylphenyl)-N-[(4-methylphenyl)methyl]-[123]triazolo[15-a]quinazolin-5-amine

SMILES

Cc1ccc(CNc2nc3c(-c4cc(C)ccc4)nnn3c3c2cccc3)cc1

InChI

InChI=1S/C24H21N5/c1-16-10-12-18(13-11-16)15-25-23-20-8-3-4-9-21(20)29-24(26-23)22(27-28-29)19-7-5-6-17(2)14-19/h3-14H,15H2,1-2H3,(H,25,26)

InChI Key

NOBDLAFCGPRQDT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06403317

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.46

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.389

Distribution Coefficient, logD

5.389

Water Solubility, LogSw

-5.88

Polar Surface Area

43.070

Acid Dissociation Constant (pKa)

18.68

Base Dissociation Constant (pKb)

3.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

References: we are preparing a list of scientific research reports with C680-0562 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C680-0562?
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What is the minimum amount of C680-0562 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C680-0562
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C680-0562
  • 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 C680-0562 available by request