D153-0114 Screening compound: 1-(3-chloro-4-methylphenyl)-1H-1,2,3,4-tetrazole

D153-0114 Screening compound: 1-(3-chloro-4-methylphenyl)-1H-1,2,3,4-tetrazole
D153-0114 Screening compound: 1-(3-chloro-4-methylphenyl)-1H-1,2,3,4-tetrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound D153-0114
1-(3-chloro-4-methylphenyl)-1H-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

D153-0114

Molecular Formula

C8H7ClN4 (C8 H7 ClN4)

Compound Name

1-(3-chloro-4-methylphenyl)-1H-1,2,3,4-tetrazole

IUPAC name

1-(3-chloro-4-methylphenyl)-1H-1234-tetrazole

SMILES

Cc(ccc(-n1nnnc1)c1)c1Cl

InChI

InChI=1S/C8H7ClN4/c1-6-2-3-7(4-8(6)9)13-5-10-11-12-13/h2-5H,1H3

InChI Key

NKKKIAZDUPTSKG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00606194

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

194.62

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.570

Distribution Coefficient, logD

2.570

Water Solubility, LogSw

-3.07

Polar Surface Area

40.004

Acid Dissociation Constant (pKa)

28.37

Base Dissociation Constant (pKb)

-2.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

D153-0114 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Dark Chemical Matter Library (18430 compounds)

Fragments Library (11262 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Targeted Diversity Library (40567 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
  • Fragments

References: we are preparing a list of scientific research reports with D153-0114 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D153-0114?
Check Price and Availability of D153-0114, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D153-0114 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D153-0114
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D153-0114
  • 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 D153-0114 available by request