2044-1960 Screening compound: N-[2-(1H-1,3-benzodiazol-2-yl)phenyl]-4-cyanobenzamide

2044-1960 Screening compound: N-[2-(1H-1,3-benzodiazol-2-yl)phenyl]-4-cyanobenzamide
2044-1960 Screening compound: N-[2-(1H-1,3-benzodiazol-2-yl)phenyl]-4-cyanobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2044-1960
N-[2-(1H-1,3-benzodiazol-2-yl)phenyl]-4-cyanobenzamide

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

2044-1960

Molecular Formula

C21H14N4O (C21 H14 N4 O)

Compound Name

N-[2-(1H-1,3-benzodiazol-2-yl)phenyl]-4-cyanobenzamide

IUPAC name

N-[2-(1H-13-benzodiazol-2-yl)phenyl]-4-cyanobenzamide

SMILES

N#Cc(cc1)ccc1C(Nc(cccc1)c1-c1nc(cccc2)c2[nH]1)=O

InChI

InChI=1S/C21H14N4O/c22-13-14-9-11-15(12-10-14)21(26)25-17-6-2-1-5-16(17)20-23-18-7-3-4-8-19(18)24-20/h1-12H,(H,23,24)(H,25,26)

InChI Key

LLRVXZPPDMQXIO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01464531

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.37

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.740

Distribution Coefficient, logD

3.739

Water Solubility, LogSw

-4.33

Polar Surface Area

58.708

Acid Dissociation Constant (pKa)

10.32

Base Dissociation Constant (pKb)

4.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 2044-1960 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2044-1960?
Check Price and Availability of 2044-1960, 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 2044-1960 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2044-1960
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2044-1960
  • 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 2044-1960 available by request