8008-9020 Screening compound: 3H-indole-3-carbaldehyde 3-(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)hydrazone

8008-9020 Screening compound: 3H-indole-3-carbaldehyde 3-(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)hydrazone
8008-9020 Screening compound: 3H-indole-3-carbaldehyde 3-(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)hydrazone alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-9020
3H-indole-3-carbaldehyde 3-(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

8008-9020

Molecular Formula

C12H13N7 (C12 H13 N7)

Compound Name

3H-indole-3-carbaldehyde 3-(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)hydrazone

IUPAC name

3-[(2E)-2-[(3H-indol-3-yl)methylidene]hydrazin-1-yl]-5-methyl-4H-124-triazol-4-amine

SMILES

Cc1nnc(N/N=C/C2c(cccc3)c3N=C2)n1N

InChI

InChI=1S/C12H13N7/c1-8-16-18-12(19(8)13)17-15-7-9-6-14-11-5-3-2-4-10(9)11/h2-7,9H,13H2,1H3,(H,17,18)/t9-/m1/s1

InChI Key

HSCOWNACSNUYME-SECBINFHSA-N

MDL Number (MFCD)

MFCD01460309

Chemical and Physical Properties

Saltdata

2HCl

Molecular Weight

255.28

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-0.312

Distribution Coefficient, logD

-1.544

Water Solubility, LogSw

-1.21

Polar Surface Area

75.241

Acid Dissociation Constant (pKa)

6.19

Base Dissociation Constant (pKb)

4.05

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.67

8008-9020 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 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 8008-9020 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-9020?
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What is the minimum amount of 8008-9020 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-9020
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-9020
  • 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 8008-9020 available by request