2085-0027 Screening compound: 6-chloro-6'-methyl-4,4'-diphenyl-1',2'-dihydro-[2,3'-biquinolin]-2'-one

2085-0027 Screening compound: 6-chloro-6'-methyl-4,4'-diphenyl-1',2'-dihydro-[2,3'-biquinolin]-2'-one
2085-0027 Screening compound: 6-chloro-6'-methyl-4,4'-diphenyl-1',2'-dihydro-[2,3'-biquinolin]-2'-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 2085-0027
6-chloro-6'-methyl-4,4'-diphenyl-1',2'-dihydro-[2,3'-biquinolin]-2'-one

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

2085-0027

Molecular Formula

C31H21ClN2O (C31 H21 ClN2 O)

Compound Name

6-chloro-6'-methyl-4,4'-diphenyl-1',2'-dihydro-[2,3'-biquinolin]-2'-one

IUPAC name

6-chloro-6'-methyl-44'-diphenyl-1'2'-dihydro-[23'-biquinolin]-2'-one

SMILES

Cc(cc1)cc(C(c2ccccc2)=C2c3cc(-c4ccccc4)c(cc(cc4)Cl)c4n3)c1NC2=O

InChI

InChI=1S/C31H21ClN2O/c1-19-12-14-27-25(16-19)29(21-10-6-3-7-11-21)30(31(35)34-27)28-18-23(20-8-4-2-5-9-20)24-17-22(32)13-15-26(24)33-28/h2-18H,1H3,(H,34,35)

InChI Key

SSTDEQOJWWIMOI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01152699

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.97

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

8.314

Distribution Coefficient, logD

8.314

Water Solubility, LogSw

-6.37

Polar Surface Area

32.632

Acid Dissociation Constant (pKa)

11.01

Base Dissociation Constant (pKb)

2.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

3.20

2085-0027 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 2085-0027 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2085-0027?
Check Price and Availability of 2085-0027, 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 2085-0027 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2085-0027
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2085-0027
  • 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 2085-0027 available by request