8006-3723 Screening compound: 2-[5-(2-cyanophenyl)-2H-1,2,3,4-tetrazol-2-yl]-N'-[(E)-(2,4-dichloro-5-nitrophenyl)methylidene]acetohydrazide

8006-3723 Screening compound: 2-[5-(2-cyanophenyl)-2H-1,2,3,4-tetrazol-2-yl]-N'-[(E)-(2,4-dichloro-5-nitrophenyl)methylidene]acetohydrazide
8006-3723 Screening compound: 2-[5-(2-cyanophenyl)-2H-1,2,3,4-tetrazol-2-yl]-N'-[(E)-(2,4-dichloro-5-nitrophenyl)methylidene]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-3723
2-[5-(2-cyanophenyl)-2H-1,2,3,4-tetrazol-2-yl]-N'-[(E)-(2,4-dichloro-5-nitrophenyl)methylidene]acetohydrazide

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

8006-3723

Molecular Formula

C17H10Cl2N8O3 (C17 H10 Cl2 N8 O3)

Compound Name

2-[5-(2-cyanophenyl)-2H-1,2,3,4-tetrazol-2-yl]-N'-[(E)-(2,4-dichloro-5-nitrophenyl)methylidene]acetohydrazide

IUPAC name

2-[5-(2-cyanophenyl)-2H-1234-tetrazol-2-yl]-N'-[(E)-(24-dichloro-5-nitrophenyl)methylidene]acetohydrazide

SMILES

N#Cc(cccc1)c1-c1nn(CC(N/N=C/c(c(Cl)c2)cc([N+]([O-])=O)c2Cl)=O)nn1

InChI

InChI=1S/C17H10Cl2N8O3/c18-13-6-14(19)15(27(29)30)5-11(13)8-21-22-16(28)9-26-24-17(23-25-26)12-4-2-1-3-10(12)7-20/h1-6,8H,9H2,(H,22,28)

InChI Key

FODKKIQTEAMGQT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00606214

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.22

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

3.029

Distribution Coefficient, logD

3.027

Water Solubility, LogSw

-3.78

Polar Surface Area

123.852

Acid Dissociation Constant (pKa)

9.90

Base Dissociation Constant (pKb)

0.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

8006-3723 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8006-3723 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-3723?
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What is the minimum amount of 8006-3723 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-3723
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-3723
  • 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 8006-3723 available by request