C276-0681 Screening compound: 6,7-dimethoxy-4-[3-methoxy-2-(propan-2-yloxy)phenyl]-1,2,3,4-tetrahydroquinolin-2-one

C276-0681 Screening compound: 6,7-dimethoxy-4-[3-methoxy-2-(propan-2-yloxy)phenyl]-1,2,3,4-tetrahydroquinolin-2-one
C276-0681 Screening compound: 6,7-dimethoxy-4-[3-methoxy-2-(propan-2-yloxy)phenyl]-1,2,3,4-tetrahydroquinolin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C276-0681
6,7-dimethoxy-4-[3-methoxy-2-(propan-2-yloxy)phenyl]-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

C276-0681

Molecular Formula

C21H25NO5 (C21 H25 NO5)

Compound Name

6,7-dimethoxy-4-[3-methoxy-2-(propan-2-yloxy)phenyl]-1,2,3,4-tetrahydroquinolin-2-one

IUPAC name

67-dimethoxy-4-[3-methoxy-2-(propan-2-yloxy)phenyl]-1234-tetrahydroquinolin-2-one

SMILES

CC(C)Oc1c(C(C2)c(cc(c(OC)c3)OC)c3NC2=O)cccc1OC

InChI

InChI=1S/C21H25NO5/c1-12(2)27-21-13(7-6-8-17(21)24-3)14-10-20(23)22-16-11-19(26-5)18(25-4)9-15(14)16/h6-9,11-12,14H,10H2,1-5H3,(H,22,23)/t14-/m1/s1

InChI Key

LHHCYFNSBLUYPW-CQSZACIVSA-N

MDL Number (MFCD)

MFCD06752749

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.866

Distribution Coefficient, logD

2.866

Water Solubility, LogSw

-3.36

Polar Surface Area

54.655

Acid Dissociation Constant (pKa)

11.12

Base Dissociation Constant (pKb)

-0.49

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

C276-0681 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-Aging Library (44940 compounds)

BRD4 Targeted Library (4534 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
Mechanism of action:
  • Epigenetic
Targets:
  • Others

References: we are preparing a list of scientific research reports with C276-0681 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C276-0681?
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What is the minimum amount of C276-0681 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C276-0681
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C276-0681
  • 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 C276-0681 available by request