6560-0307 Screening compound: {1-[(2-methoxyphenyl)methyl]-1H-1,3-benzodiazol-2-yl}methanol

6560-0307 Screening compound: {1-[(2-methoxyphenyl)methyl]-1H-1,3-benzodiazol-2-yl}methanol
6560-0307 Screening compound: {1-[(2-methoxyphenyl)methyl]-1H-1,3-benzodiazol-2-yl}methanol alternative view

Chemical Structure Depiction of ChemDiv screening compound 6560-0307
{1-[(2-methoxyphenyl)methyl]-1H-1,3-benzodiazol-2-yl}methanol

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

6560-0307

Molecular Formula

C16H16N2O2 (C16 H16 N2 O2)

Compound Name

{1-[(2-methoxyphenyl)methyl]-1H-1,3-benzodiazol-2-yl}methanol

IUPAC name

{1-[(2-methoxyphenyl)methyl]-1H-13-benzodiazol-2-yl}methanol

SMILES

COc1c(Cn2c(cccc3)c3nc2CO)cccc1

InChI

InChI=1S/C16H16N2O2/c1-20-15-9-5-2-6-12(15)10-18-14-8-4-3-7-13(14)17-16(18)11-19/h2-9,19H,10-11H2,1H3

InChI Key

VQAOBKHLDSXVAY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03267030

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

268.32

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.865

Distribution Coefficient, logD

2.861

Water Solubility, LogSw

-2.96

Polar Surface Area

35.889

Acid Dissociation Constant (pKa)

14.71

Base Dissociation Constant (pKb)

5.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

6560-0307 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

CNS BBB Library (22607 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 6560-0307 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6560-0307?
Check Price and Availability of 6560-0307, 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 6560-0307 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6560-0307
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6560-0307
  • 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 6560-0307 available by request