1322-0003 Screening compound: 4-methyl-N'-[(2E)-1-(5-nitro-2H-1,2,3,4-tetrazol-2-yl)propan-2-ylidene]benzohydrazide

1322-0003 Screening compound: 4-methyl-N'-[(2E)-1-(5-nitro-2H-1,2,3,4-tetrazol-2-yl)propan-2-ylidene]benzohydrazide
1322-0003 Screening compound: 4-methyl-N'-[(2E)-1-(5-nitro-2H-1,2,3,4-tetrazol-2-yl)propan-2-ylidene]benzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1322-0003
4-methyl-N'-[(2E)-1-(5-nitro-2H-1,2,3,4-tetrazol-2-yl)propan-2-ylidene]benzohydrazide

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

1322-0003

Molecular Formula

C12H13N7O3 (C12 H13 N7 O3)

Compound Name

4-methyl-N'-[(2E)-1-(5-nitro-2H-1,2,3,4-tetrazol-2-yl)propan-2-ylidene]benzohydrazide

IUPAC name

4-methyl-N'-[(2E)-1-(5-nitro-2H-1234-tetrazol-2-yl)propan-2-ylidene]benzohydrazide

SMILES

C/C(/Cn1nnc([N+]([O-])=O)n1)=N\NC(c1ccc(C)cc1)=O

InChI

InChI=1S/C12H13N7O3/c1-8-3-5-10(6-4-8)11(20)14-13-9(2)7-18-16-12(15-17-18)19(21)22/h3-6H,7H2,1-2H3,(H,14,20)

InChI Key

JVZFFWGDNCFCIS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01243501

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

303.28

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.266

Distribution Coefficient, logD

1.245

Water Solubility, LogSw

-2.24

Polar Surface Area

105.878

Acid Dissociation Constant (pKa)

8.71

Base Dissociation Constant (pKb)

1.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

1322-0003 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 1322-0003 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1322-0003?
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What is the minimum amount of 1322-0003 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1322-0003
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1322-0003
  • 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 1322-0003 available by request