Y207-5514 Screening compound: 4-(3,4-DIETHOXYPHENYL)-7-(4-ETHOXYPHENYL)-4,6,7,8-TETRAHYDRO-2,5(1H,3H)-QUINOLINEDIONE

Y207-5514 Screening compound: 4-(3,4-DIETHOXYPHENYL)-7-(4-ETHOXYPHENYL)-4,6,7,8-TETRAHYDRO-2,5(1H,3H)-QUINOLINEDIONE
Y207-5514 Screening compound: 4-(3,4-DIETHOXYPHENYL)-7-(4-ETHOXYPHENYL)-4,6,7,8-TETRAHYDRO-2,5(1H,3H)-QUINOLINEDIONE alternative view

Chemical Structure Depiction of ChemDiv screening compound Y207-5514
4-(3,4-DIETHOXYPHENYL)-7-(4-ETHOXYPHENYL)-4,6,7,8-TETRAHYDRO-2,5(1H,3H)-QUINOLINEDIONE

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

Y207-5514

Molecular Formula

C27H31NO5 (C27 H31 NO5)

Compound Name

4-(3,4-DIETHOXYPHENYL)-7-(4-ETHOXYPHENYL)-4,6,7,8-TETRAHYDRO-2,5(1H,3H)-QUINOLINEDIONE

IUPAC name

4-(34-diethoxyphenyl)-7-(4-ethoxyphenyl)-12345678-octahydroquinoline-25-dione

SMILES

CCOc1ccc(C(C2)CC(NC(CC3c(cc4)cc(OCC)c4OCC)=O)=C3C2=O)cc1

InChI

InChI=1S/C27H31NO5/c1-4-31-20-10-7-17(8-11-20)19-13-22-27(23(29)14-19)21(16-26(30)28-22)18-9-12-24(32-5-2)25(15-18)33-6-3/h7-12,15,19,21H,4-6,13-14,16H2,1-3H3,(H,28,30)

InChI Key

IKVACRCQGSUKKO-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.55

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.118

Distribution Coefficient, logD

2.855

Water Solubility, LogSw

-4.20

Polar Surface Area

59.279

Acid Dissociation Constant (pKa)

6.16

Base Dissociation Constant (pKb)

-0.95

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

40.74

Y207-5514 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y207-5514 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y207-5514?
Check Price and Availability of Y207-5514, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of Y207-5514 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y207-5514
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y207-5514
  • 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 Y207-5514 available by request