C276-0567 Screening compound: 4-(5-bromo-2-ethoxyphenyl)-7,8-dimethyl-1,2,3,4-tetrahydroquinolin-2-one

C276-0567 Screening compound: 4-(5-bromo-2-ethoxyphenyl)-7,8-dimethyl-1,2,3,4-tetrahydroquinolin-2-one
C276-0567 Screening compound: 4-(5-bromo-2-ethoxyphenyl)-7,8-dimethyl-1,2,3,4-tetrahydroquinolin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C276-0567
4-(5-bromo-2-ethoxyphenyl)-7,8-dimethyl-1,2,3,4-tetrahydroquinolin-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

C276-0567

Molecular Formula

C19H20BrNO2 (C19 H20 BrNO2)

Compound Name

4-(5-bromo-2-ethoxyphenyl)-7,8-dimethyl-1,2,3,4-tetrahydroquinolin-2-one

IUPAC name

4-(5-bromo-2-ethoxyphenyl)-78-dimethyl-1234-tetrahydroquinolin-2-one

SMILES

CCOc(cc1)c(C(C2)c(ccc(C)c3C)c3NC2=O)cc1Br

InChI

InChI=1S/C19H20BrNO2/c1-4-23-17-8-6-13(20)9-16(17)15-10-18(22)21-19-12(3)11(2)5-7-14(15)19/h5-9,15H,4,10H2,1-3H3,(H,21,22)/t15-/m0/s1

InChI Key

XPMOVAKPKNSGAT-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD06754294

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.28

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

5.045

Distribution Coefficient, logD

5.045

Water Solubility, LogSw

-4.68

Polar Surface Area

29.746

Acid Dissociation Constant (pKa)

12.37

Base Dissociation Constant (pKb)

-1.32

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.60

C276-0567 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C276-0567 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C276-0567?
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What is the minimum amount of C276-0567 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C276-0567
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C276-0567
  • 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 C276-0567 available by request