8008-2610 Screening compound: 2,4-bis(4-methylpiperidino)-5-nitrobenzaldehyde 1-(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)hydrazone

8008-2610 Screening compound: 2,4-bis(4-methylpiperidino)-5-nitrobenzaldehyde 1-(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)hydrazone
8008-2610 Screening compound: 2,4-bis(4-methylpiperidino)-5-nitrobenzaldehyde 1-(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)hydrazone alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-2610
2,4-bis(4-methylpiperidino)-5-nitrobenzaldehyde 1-(4-amino-5-methyl-4H-1,2,4-triazol-3-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

8008-2610

Molecular Formula

C22H33N9O2 (C22 H33 N9 O2)

Compound Name

2,4-bis(4-methylpiperidino)-5-nitrobenzaldehyde 1-(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)hydrazone

IUPAC name

3-[(2Z)-2-{[24-bis(4-methylpiperidin-1-yl)-5-nitrophenyl]methylidene}hydrazin-1-yl]-5-methyl-4H-124-triazol-4-amine

SMILES

CC(CC1)CCN1c(c(/C=N\Nc1nnc(C)n1N)c1)cc(N2CCC(C)CC2)c1[N+]([O-])=O

InChI

InChI=1S/C22H33N9O2/c1-15-4-8-28(9-5-15)19-13-20(29-10-6-16(2)7-11-29)21(31(32)33)12-18(19)14-24-26-22-27-25-17(3)30(22)23/h12-16H,4-11,23H2,1-3H3,(H,26,27)

InChI Key

LVUBBZPTPZIYDU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01532772

Chemical and Physical Properties

Saltdata

2HCl

Molecular Weight

455.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

3.659

Distribution Coefficient, logD

3.659

Water Solubility, LogSw

-4.15

Polar Surface Area

105.306

Acid Dissociation Constant (pKa)

12.27

Base Dissociation Constant (pKb)

3.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

59.09

8008-2610 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 8008-2610 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-2610?
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What is the minimum amount of 8008-2610 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-2610
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-2610
  • 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 8008-2610 available by request