J103-0322 Screening compound: N-[2-(1-methyl-1H-1,3-benzodiazol-2-yl)ethyl]-2-(3-oxo-2,3,5,6,7,8-hexahydrocinnolin-2-yl)acetamide

J103-0322 Screening compound: N-[2-(1-methyl-1H-1,3-benzodiazol-2-yl)ethyl]-2-(3-oxo-2,3,5,6,7,8-hexahydrocinnolin-2-yl)acetamide
J103-0322 Screening compound: N-[2-(1-methyl-1H-1,3-benzodiazol-2-yl)ethyl]-2-(3-oxo-2,3,5,6,7,8-hexahydrocinnolin-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J103-0322
N-[2-(1-methyl-1H-1,3-benzodiazol-2-yl)ethyl]-2-(3-oxo-2,3,5,6,7,8-hexahydrocinnolin-2-yl)acetamide

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

J103-0322

Molecular Formula

C20H23N5O2 (C20 H23 N5 O2)

Compound Name

N-[2-(1-methyl-1H-1,3-benzodiazol-2-yl)ethyl]-2-(3-oxo-2,3,5,6,7,8-hexahydrocinnolin-2-yl)acetamide

IUPAC name

N-[2-(1-methyl-1H-13-benzodiazol-2-yl)ethyl]-2-(3-oxo-235678-hexahydrocinnolin-2-yl)acetamide

SMILES

Cn1c(cccc2)c2nc1CCNC(CN1N=C(CCCC2)C2=CC1=O)=O

InChI

InChI=1S/C20H23N5O2/c1-24-17-9-5-4-8-16(17)22-18(24)10-11-21-19(26)13-25-20(27)12-14-6-2-3-7-15(14)23-25/h4-5,8-9,12H,2-3,6-7,10-11,13H2,1H3,(H,21,26)

InChI Key

ZAKMYZMRGKQLQJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27962971

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.259

Distribution Coefficient, logD

1.189

Water Solubility, LogSw

-2.22

Polar Surface Area

64.532

Acid Dissociation Constant (pKa)

15.08

Base Dissociation Constant (pKb)

6.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

J103-0322 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with J103-0322 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J103-0322?
Check Price and Availability of J103-0322, 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 J103-0322 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J103-0322
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J103-0322
  • 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 J103-0322 available by request