C647-0141 Screening compound: 2-[6,7-dimethoxy-3-(4-methoxybenzoyl)-4-oxo-1,4-dihydroquinolin-1-yl]-N-(3,4-dimethoxyphenyl)acetamide

C647-0141 Screening compound: 2-[6,7-dimethoxy-3-(4-methoxybenzoyl)-4-oxo-1,4-dihydroquinolin-1-yl]-N-(3,4-dimethoxyphenyl)acetamide
C647-0141 Screening compound: 2-[6,7-dimethoxy-3-(4-methoxybenzoyl)-4-oxo-1,4-dihydroquinolin-1-yl]-N-(3,4-dimethoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C647-0141
2-[6,7-dimethoxy-3-(4-methoxybenzoyl)-4-oxo-1,4-dihydroquinolin-1-yl]-N-(3,4-dimethoxyphenyl)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

C647-0141

Molecular Formula

C29H28N2O8 (C29 H28 N2 O8)

Compound Name

2-[6,7-dimethoxy-3-(4-methoxybenzoyl)-4-oxo-1,4-dihydroquinolin-1-yl]-N-(3,4-dimethoxyphenyl)acetamide

IUPAC name

2-[67-dimethoxy-3-(4-methoxybenzoyl)-4-oxo-14-dihydroquinolin-1-yl]-N-(34-dimethoxyphenyl)acetamide

SMILES

COc(cc1)ccc1C(C1=CN(CC(Nc(cc2)cc(OC)c2OC)=O)c(cc(c(OC)c2)OC)c2C1=O)=O

InChI

InChI=1S/C29H28N2O8/c1-35-19-9-6-17(7-10-19)28(33)21-15-31(22-14-26(39-5)25(38-4)13-20(22)29(21)34)16-27(32)30-18-8-11-23(36-2)24(12-18)37-3/h6-15H,16H2,1-5H3,(H,30,32)

InChI Key

HPVHDQWUIOLYMZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14779011

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

532.55

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

3.283

Distribution Coefficient, logD

3.283

Water Solubility, LogSw

-3.79

Polar Surface Area

90.244

Acid Dissociation Constant (pKa)

11.41

Base Dissociation Constant (pKb)

2.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.70

C647-0141 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Receptor's ligands
Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with C647-0141 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C647-0141?
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What is the minimum amount of C647-0141 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C647-0141
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C647-0141
  • 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 C647-0141 available by request