D011-4846 Screening compound: N-[(5-methyl-1H-1,3-benzodiazol-2-yl)methyl]benzamide

D011-4846 Screening compound: N-[(5-methyl-1H-1,3-benzodiazol-2-yl)methyl]benzamide
D011-4846 Screening compound: N-[(5-methyl-1H-1,3-benzodiazol-2-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D011-4846
N-[(5-methyl-1H-1,3-benzodiazol-2-yl)methyl]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

D011-4846

Molecular Formula

C16H15N3O (C16 H15 N3 O)

Compound Name

N-[(5-methyl-1H-1,3-benzodiazol-2-yl)methyl]benzamide

IUPAC name

N-[(5-methyl-1H-13-benzodiazol-2-yl)methyl]benzamide

SMILES

Cc(cc1)cc2c1[nH]c(CNC(c1ccccc1)=O)n2

InChI

InChI=1S/C16H15N3O/c1-11-7-8-13-14(9-11)19-15(18-13)10-17-16(20)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,17,20)(H,18,19)

InChI Key

QPVRVAHMGKEFOO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00244017

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

265.31

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.018

Distribution Coefficient, logD

3.018

Water Solubility, LogSw

-3.31

Polar Surface Area

44.933

Acid Dissociation Constant (pKa)

11.17

Base Dissociation Constant (pKb)

3.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

D011-4846 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

Cardiovascular Library (22201 compounds)

Fragments Library (11262 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
  • Fragments
Therapeutical areas:
  • Cardiovascular
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with D011-4846 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D011-4846?
Check Price and Availability of D011-4846, 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 D011-4846 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D011-4846
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D011-4846
  • 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 D011-4846 available by request