8018-2421 Screening compound: N-[(2,6-dichlorophenyl)methyl]-1-(prop-2-en-1-yl)-1H-1,2,3,4-tetrazol-5-amine

8018-2421 Screening compound: N-[(2,6-dichlorophenyl)methyl]-1-(prop-2-en-1-yl)-1H-1,2,3,4-tetrazol-5-amine
8018-2421 Screening compound: N-[(2,6-dichlorophenyl)methyl]-1-(prop-2-en-1-yl)-1H-1,2,3,4-tetrazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-2421
N-[(2,6-dichlorophenyl)methyl]-1-(prop-2-en-1-yl)-1H-1,2,3,4-tetrazol-5-amine

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

8018-2421

Molecular Formula

C11H11Cl2N5 (C11 H11 Cl2 N5)

Compound Name

N-[(2,6-dichlorophenyl)methyl]-1-(prop-2-en-1-yl)-1H-1,2,3,4-tetrazol-5-amine

IUPAC name

N-[(26-dichlorophenyl)methyl]-1-(prop-2-en-1-yl)-1H-1234-tetrazol-5-amine

SMILES

C=CCn1nnnc1NCc(c(Cl)ccc1)c1Cl

InChI

InChI=1S/C11H11Cl2N5/c1-2-6-18-11(15-16-17-18)14-7-8-9(12)4-3-5-10(8)13/h2-5H,1,6-7H2,(H,14,15,17)

InChI Key

LHMLVCRFYKGWIG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06753427

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

284.15

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.821

Distribution Coefficient, logD

2.821

Water Solubility, LogSw

-3.52

Polar Surface Area

51.834

Acid Dissociation Constant (pKa)

16.77

Base Dissociation Constant (pKb)

-0.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.18

8018-2421 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
  • Agro

References: we are preparing a list of scientific research reports with 8018-2421 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-2421?
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What is the minimum amount of 8018-2421 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-2421
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-2421
  • 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 8018-2421 available by request