C276-1234 Screening compound: 6,7-diethoxy-4-[2-(propan-2-yloxy)phenyl]-1,2,3,4-tetrahydroquinolin-2-one

C276-1234 Screening compound: 6,7-diethoxy-4-[2-(propan-2-yloxy)phenyl]-1,2,3,4-tetrahydroquinolin-2-one
C276-1234 Screening compound: 6,7-diethoxy-4-[2-(propan-2-yloxy)phenyl]-1,2,3,4-tetrahydroquinolin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C276-1234
6,7-diethoxy-4-[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

C276-1234

Molecular Formula

C22H27NO4 (C22 H27 NO4)

Compound Name

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

IUPAC name

67-diethoxy-4-[2-(propan-2-yloxy)phenyl]-1234-tetrahydroquinolin-2-one

SMILES

CCOc(c(OCC)c1)cc(C(C2)c(cccc3)c3OC(C)C)c1NC2=O

InChI

InChI=1S/C22H27NO4/c1-5-25-20-11-17-16(15-9-7-8-10-19(15)27-14(3)4)12-22(24)23-18(17)13-21(20)26-6-2/h7-11,13-14,16H,5-6,12H2,1-4H3,(H,23,24)/t16-/m1/s1

InChI Key

XOTCGYLRXKJSNY-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD07402419

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.264

Distribution Coefficient, logD

3.264

Water Solubility, LogSw

-3.44

Polar Surface Area

46.097

Acid Dissociation Constant (pKa)

11.12

Base Dissociation Constant (pKb)

-0.57

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.90

C276-1234 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with C276-1234 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C276-1234?
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What is the minimum amount of C276-1234 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C276-1234
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C276-1234
  • 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 C276-1234 available by request