C276-1518 Screening compound: 7-(4-methoxyphenyl)-4-(4-propoxyphenyl)-1,2,3,4,5,6,7,8-octahydroquinoline-2,5-dione

C276-1518 Screening compound: 7-(4-methoxyphenyl)-4-(4-propoxyphenyl)-1,2,3,4,5,6,7,8-octahydroquinoline-2,5-dione
C276-1518 Screening compound: 7-(4-methoxyphenyl)-4-(4-propoxyphenyl)-1,2,3,4,5,6,7,8-octahydroquinoline-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound C276-1518
7-(4-methoxyphenyl)-4-(4-propoxyphenyl)-1,2,3,4,5,6,7,8-octahydroquinoline-2,5-dione

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

C276-1518

Molecular Formula

C25H27NO4 (C25 H27 NO4)

Compound Name

7-(4-methoxyphenyl)-4-(4-propoxyphenyl)-1,2,3,4,5,6,7,8-octahydroquinoline-2,5-dione

IUPAC name

7-(4-methoxyphenyl)-4-(4-propoxyphenyl)-12345678-octahydroquinoline-25-dione

SMILES

CCCOc1ccc(C(C2)C(C(CC(C3)c(cc4)ccc4OC)=O)=C3NC2=O)cc1

InChI

InChI=1S/C25H27NO4/c1-3-12-30-20-10-6-17(7-11-20)21-15-24(28)26-22-13-18(14-23(27)25(21)22)16-4-8-19(29-2)9-5-16/h4-11,18,21H,3,12-15H2,1-2H3,(H,26,28)

InChI Key

HQFGILQUBKETAX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07613389

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.500

Distribution Coefficient, logD

3.237

Water Solubility, LogSw

-4.29

Polar Surface Area

52.696

Acid Dissociation Constant (pKa)

6.16

Base Dissociation Constant (pKb)

-0.95

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

36.00

C276-1518 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C276-1518 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C276-1518?
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What is the minimum amount of C276-1518 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C276-1518
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C276-1518
  • 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 C276-1518 available by request