8018-9521 Screening compound: 3-{2-[(3-chlorophenyl)methyl]-2H-1,2,3,4-tetrazol-5-yl}pyridine

8018-9521 Screening compound: 3-{2-[(3-chlorophenyl)methyl]-2H-1,2,3,4-tetrazol-5-yl}pyridine
8018-9521 Screening compound: 3-{2-[(3-chlorophenyl)methyl]-2H-1,2,3,4-tetrazol-5-yl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-9521
3-{2-[(3-chlorophenyl)methyl]-2H-1,2,3,4-tetrazol-5-yl}pyridine

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

8018-9521

Molecular Formula

C13H10ClN5 (C13 H10 ClN5)

Compound Name

3-{2-[(3-chlorophenyl)methyl]-2H-1,2,3,4-tetrazol-5-yl}pyridine

IUPAC name

3-{2-[(3-chlorophenyl)methyl]-2H-1234-tetrazol-5-yl}pyridine

SMILES

Clc1cc(Cn2nnc(-c3cnccc3)n2)ccc1

InChI

InChI=1S/C13H10ClN5/c14-12-5-1-3-10(7-12)9-19-17-13(16-18-19)11-4-2-6-15-8-11/h1-8H,9H2

InChI Key

VFVNBGQMVBZCCT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09063253

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

271.71

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.401

Distribution Coefficient, logD

1.929

Water Solubility, LogSw

-2.77

Polar Surface Area

47.859

Acid Dissociation Constant (pKa)

26.55

Base Dissociation Constant (pKb)

7.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.69

8018-9521 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 8018-9521 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-9521?
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What is the minimum amount of 8018-9521 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-9521
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-9521
  • 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 8018-9521 available by request