8019-4764 Screening compound: 5-(3-fluorophenyl)-2-[(1H-1,2,3,4-tetrazol-5-yl)methyl]-2H-1,2,3,4-tetrazole

8019-4764 Screening compound: 5-(3-fluorophenyl)-2-[(1H-1,2,3,4-tetrazol-5-yl)methyl]-2H-1,2,3,4-tetrazole
8019-4764 Screening compound: 5-(3-fluorophenyl)-2-[(1H-1,2,3,4-tetrazol-5-yl)methyl]-2H-1,2,3,4-tetrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-4764
5-(3-fluorophenyl)-2-[(1H-1,2,3,4-tetrazol-5-yl)methyl]-2H-1,2,3,4-tetrazole

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

8019-4764

Molecular Formula

C9H7FN8 (C9 H7 FN8)

Compound Name

5-(3-fluorophenyl)-2-[(1H-1,2,3,4-tetrazol-5-yl)methyl]-2H-1,2,3,4-tetrazole

IUPAC name

5-(3-fluorophenyl)-2-[(1H-1234-tetrazol-5-yl)methyl]-2H-1234-tetrazole

SMILES

Fc1cc(-c2nn(Cc3nnn[nH]3)nn2)ccc1

InChI

InChI=1S/C9H7FN8/c10-7-3-1-2-6(4-7)9-13-17-18(14-9)5-8-11-15-16-12-8/h1-4H,5H2,(H,11,12,15,16)

InChI Key

ZHKCYPOCAPISRJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10037896

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

246.21

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.934

Distribution Coefficient, logD

-1.121

Water Solubility, LogSw

-1.24

Polar Surface Area

89.717

Acid Dissociation Constant (pKa)

5.87

Base Dissociation Constant (pKb)

2.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

8019-4764 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8019-4764 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-4764?
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What is the minimum amount of 8019-4764 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-4764
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-4764
  • 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 8019-4764 available by request