2226-0429 Screening compound: N-{1-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-2-yl}benzamide

2226-0429 Screening compound: N-{1-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-2-yl}benzamide
2226-0429 Screening compound: N-{1-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-2-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2226-0429
N-{1-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-2-yl}benzamide

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

2226-0429

Molecular Formula

C21H16ClN3O (C21 H16 ClN3 O)

Compound Name

N-{1-[(2-chlorophenyl)methyl]-1H-1,3-benzodiazol-2-yl}benzamide

IUPAC name

N-{1-[(2-chlorophenyl)methyl]-1H-13-benzodiazol-2-yl}benzamide

SMILES

O=C(c1ccccc1)Nc1nc(cccc2)c2n1Cc(cccc1)c1Cl

InChI

InChI=1S/C21H16ClN3O/c22-17-11-5-4-10-16(17)14-25-19-13-7-6-12-18(19)23-21(25)24-20(26)15-8-2-1-3-9-15/h1-13H,14H2,(H,23,24,26)

InChI Key

XXIFIKVCYUSTLE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01413243

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

361.83

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.132

Distribution Coefficient, logD

5.132

Water Solubility, LogSw

-5.67

Polar Surface Area

35.166

Acid Dissociation Constant (pKa)

11.05

Base Dissociation Constant (pKb)

2.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

2226-0429 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Nucleic Acid Ligands (8311 compounds)

Targeted Diversity Library (40567 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic
Targets:
  • Others

References: we are preparing a list of scientific research reports with 2226-0429 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2226-0429?
Check Price and Availability of 2226-0429, 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 2226-0429 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2226-0429
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2226-0429
  • 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 2226-0429 available by request