C607-0735 Screening compound: N-(3-chlorophenyl)-N-methyl-1-oxo-4-phenyl-1H-isochromene-3-carboxamide

C607-0735 Screening compound: N-(3-chlorophenyl)-N-methyl-1-oxo-4-phenyl-1H-isochromene-3-carboxamide
C607-0735 Screening compound: N-(3-chlorophenyl)-N-methyl-1-oxo-4-phenyl-1H-isochromene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C607-0735
N-(3-chlorophenyl)-N-methyl-1-oxo-4-phenyl-1H-isochromene-3-carboxamide

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

C607-0735

Molecular Formula

C23H16ClNO3 (C23 H16 ClNO3)

Compound Name

N-(3-chlorophenyl)-N-methyl-1-oxo-4-phenyl-1H-isochromene-3-carboxamide

IUPAC name

N-(3-chlorophenyl)-N-methyl-1-oxo-4-phenyl-1H-isochromene-3-carboxamide

SMILES

CN(C(C(O1)=C(c2ccccc2)c(cccc2)c2C1=O)=O)c1cccc(Cl)c1

InChI

InChI=1S/C23H16ClNO3/c1-25(17-11-7-10-16(24)14-17)22(26)21-20(15-8-3-2-4-9-15)18-12-5-6-13-19(18)23(27)28-21/h2-14H,1H3

InChI Key

NXQYRJREYHCRLY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14775275

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.84

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.659

Distribution Coefficient, logD

4.659

Water Solubility, LogSw

-4.89

Polar Surface Area

36.337

Acid Dissociation Constant (pKa)

30.60

Base Dissociation Constant (pKb)

-1.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

C607-0735 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiparasite Library (23996 compounds)

Antiviral Annotated Library (21441 compounds)

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

Cardiovascular Library (22201 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cardiovascular
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C607-0735 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C607-0735?
Check Price and Availability of C607-0735, 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 C607-0735 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C607-0735
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C607-0735
  • 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 C607-0735 available by request