8004-4537 Screening compound: 2-bromobenzaldehyde 1-(4,6-dianilino-1,3,5-triazin-2-yl)hydrazone

8004-4537 Screening compound: 2-bromobenzaldehyde 1-(4,6-dianilino-1,3,5-triazin-2-yl)hydrazone
8004-4537 Screening compound: 2-bromobenzaldehyde 1-(4,6-dianilino-1,3,5-triazin-2-yl)hydrazone alternative view

Chemical Structure Depiction of ChemDiv screening compound 8004-4537
2-bromobenzaldehyde 1-(4,6-dianilino-1,3,5-triazin-2-yl)hydrazone

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

8004-4537

Molecular Formula

C22H18BrN7 (C22 H18 BrN7)

Compound Name

2-bromobenzaldehyde 1-(4,6-dianilino-1,3,5-triazin-2-yl)hydrazone

IUPAC name

6-[(2E)-2-[(2-bromophenyl)methylidene]hydrazin-1-yl]-N2N4-diphenyl-135-triazine-24-diamine

SMILES

Brc1c(/C=N/Nc2nc(Nc3ccccc3)nc(Nc3ccccc3)n2)cccc1

InChI

InChI=1S/C22H18BrN7/c23-19-14-8-7-9-16(19)15-24-30-22-28-20(25-17-10-3-1-4-11-17)27-21(29-22)26-18-12-5-2-6-13-18/h1-15H,(H3,25,26,27,28,29,30)

InChI Key

GGBHYABTCAWTMW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00739102

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.34

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.913

Distribution Coefficient, logD

6.913

Water Solubility, LogSw

-6.43

Polar Surface Area

72.469

Acid Dissociation Constant (pKa)

13.18

Base Dissociation Constant (pKb)

4.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8004-4537 in Drug Discovery

Included in Screening Libraries

Opportunistic Pathogens of Immunocompromised Hosts Annotated Library (1773 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8004-4537 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8004-4537?
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What is the minimum amount of 8004-4537 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8004-4537
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8004-4537
  • 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 8004-4537 available by request