4130-4683 Screening compound: 1-(2,5-dichlorobenzoyl)-1H-1,2,3-benzotriazole

4130-4683 Screening compound: 1-(2,5-dichlorobenzoyl)-1H-1,2,3-benzotriazole
4130-4683 Screening compound: 1-(2,5-dichlorobenzoyl)-1H-1,2,3-benzotriazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 4130-4683
1-(2,5-dichlorobenzoyl)-1H-1,2,3-benzotriazole

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

4130-4683

Molecular Formula

C13H7Cl2N3O (C13 H7 Cl2 N3 O)

Compound Name

1-(2,5-dichlorobenzoyl)-1H-1,2,3-benzotriazole

IUPAC name

1-(25-dichlorobenzoyl)-1H-123-benzotriazole

SMILES

O=C(c(cc(cc1)Cl)c1Cl)n1nnc2c1cccc2

InChI

InChI=1S/C13H7Cl2N3O/c14-8-5-6-10(15)9(7-8)13(19)18-12-4-2-1-3-11(12)16-17-18/h1-7H

InChI Key

SZJRBMUXXRLJLB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01195638

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.12

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.338

Distribution Coefficient, logD

3.338

Water Solubility, LogSw

-3.78

Polar Surface Area

38.996

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-1.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

4130-4683 in Drug Discovery

Included in Screening Libraries

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 4130-4683 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4130-4683?
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What is the minimum amount of 4130-4683 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4130-4683
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4130-4683
  • 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 4130-4683 available by request