C200-4682 Screening compound: 3-(3-bromophenyl)-N-butyl-N-ethyl-[1,2,3]triazolo[1,5-a]quinazolin-5-amine

C200-4682 Screening compound: 3-(3-bromophenyl)-N-butyl-N-ethyl-[1,2,3]triazolo[1,5-a]quinazolin-5-amine
C200-4682 Screening compound: 3-(3-bromophenyl)-N-butyl-N-ethyl-[1,2,3]triazolo[1,5-a]quinazolin-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound C200-4682
3-(3-bromophenyl)-N-butyl-N-ethyl-[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

C200-4682

Molecular Formula

C21H22BrN5 (C21 H22 BrN5)

Compound Name

3-(3-bromophenyl)-N-butyl-N-ethyl-[1,2,3]triazolo[1,5-a]quinazolin-5-amine

IUPAC name

3-(3-bromophenyl)-N-butyl-N-ethyl-[123]triazolo[15-a]quinazolin-5-amine

SMILES

CCCCN(CC)c1nc2c(-c3cccc(Br)c3)nnn2c2c1cccc2

InChI

InChI=1S/C21H22BrN5/c1-3-5-13-26(4-2)20-17-11-6-7-12-18(17)27-21(23-20)19(24-25-27)15-9-8-10-16(22)14-15/h6-12,14H,3-5,13H2,1-2H3

InChI Key

MVPXIKYGHDSTCX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14727507

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.34

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.162

Distribution Coefficient, logD

6.160

Water Solubility, LogSw

-5.98

Polar Surface Area

35.118

Acid Dissociation Constant (pKa)

22.34

Base Dissociation Constant (pKb)

5.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with C200-4682 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C200-4682?
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What is the minimum amount of C200-4682 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C200-4682
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C200-4682
  • 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 C200-4682 available by request