8020-2380 Screening compound: 1H-1,2,3-benzotriazole-5-carbonitrile

8020-2380 Screening compound: 1H-1,2,3-benzotriazole-5-carbonitrile
8020-2380 Screening compound: 1H-1,2,3-benzotriazole-5-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-2380
1H-1,2,3-benzotriazole-5-carbonitrile

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

8020-2380

Molecular Formula

C7H4N4 (C7 H4 N4)

Compound Name

1H-1,2,3-benzotriazole-5-carbonitrile

IUPAC name

1H-123-benzotriazole-5-carbonitrile

SMILES

N#Cc(cc1)cc2c1[nH]nn2

InChI

InChI=1S/C7H4N4/c8-4-5-1-2-6-7(3-5)10-11-9-6/h1-3H,(H,9,10,11)

InChI Key

OEBMOZBCDOBXAN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08669484

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

144.14

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.001

Distribution Coefficient, logD

0.926

Water Solubility, LogSw

-1.18

Polar Surface Area

52.899

Acid Dissociation Constant (pKa)

8.13

Base Dissociation Constant (pKb)

0.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8020-2380 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 8020-2380 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-2380?
Check Price and Availability of 8020-2380, 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 8020-2380 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-2380
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-2380
  • 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 8020-2380 available by request