C680-0257 Screening compound: N-butyl-N-[3-(4-methoxyphenyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]amine

C680-0257 Screening compound: N-butyl-N-[3-(4-methoxyphenyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]amine
C680-0257 Screening compound: N-butyl-N-[3-(4-methoxyphenyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]amine alternative view

Chemical Structure Depiction of ChemDiv screening compound C680-0257
N-butyl-N-[3-(4-methoxyphenyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]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

C680-0257

Molecular Formula

C20H21N5O (C20 H21 N5 O)

Compound Name

N-butyl-N-[3-(4-methoxyphenyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]amine

IUPAC name

N-butyl-3-(4-methoxyphenyl)-[123]triazolo[15-a]quinazolin-5-amine

SMILES

CCCCNc1nc2c(-c(cc3)ccc3OC)nnn2c2c1cccc2

InChI

InChI=1S/C20H21N5O/c1-3-4-13-21-19-16-7-5-6-8-17(16)25-20(22-19)18(23-24-25)14-9-11-15(26-2)12-10-14/h5-12H,3-4,13H2,1-2H3,(H,21,22)

InChI Key

HUCCOUZAHXCETI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14782237

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.726

Distribution Coefficient, logD

4.726

Water Solubility, LogSw

-4.69

Polar Surface Area

50.727

Acid Dissociation Constant (pKa)

20.53

Base Dissociation Constant (pKb)

9.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with C680-0257 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C680-0257?
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What is the minimum amount of C680-0257 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C680-0257
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C680-0257
  • 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 C680-0257 available by request