3772-7440 Screening compound: 1-[(naphthalen-2-yl)methyl]-1H-1,3-benzodiazole

3772-7440 Screening compound: 1-[(naphthalen-2-yl)methyl]-1H-1,3-benzodiazole
3772-7440 Screening compound: 1-[(naphthalen-2-yl)methyl]-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 3772-7440
1-[(naphthalen-2-yl)methyl]-1H-1,3-benzodiazole

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

3772-7440

Molecular Formula

C18H14N2 (C18 H14 N2)

Compound Name

1-[(naphthalen-2-yl)methyl]-1H-1,3-benzodiazole

IUPAC name

1-[(naphthalen-2-yl)methyl]-1H-13-benzodiazole

SMILES

C(c1cc2ccccc2cc1)n1c(cccc2)c2nc1

InChI

InChI=1S/C18H14N2/c1-2-6-16-11-14(9-10-15(16)5-1)12-20-13-19-17-7-3-4-8-18(17)20/h1-11,13H,12H2

InChI Key

RBJWEJKVIMYELQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02074363

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

258.32

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.134

Distribution Coefficient, logD

4.129

Water Solubility, LogSw

-4.27

Polar Surface Area

10.152

Acid Dissociation Constant (pKa)

21.91

Base Dissociation Constant (pKb)

5.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.60

3772-7440 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CORONAVIRUS Library (20774 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 3772-7440 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3772-7440?
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What is the minimum amount of 3772-7440 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3772-7440
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3772-7440
  • 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 3772-7440 available by request