5609-0409 Screening compound: (5Z)-1-(4-ethoxyphenyl)-5-{[4-hydroxy-3-(prop-2-en-1-yl)phenyl]methylidene}-1,3-diazinane-2,4,6-trione

5609-0409 Screening compound: (5Z)-1-(4-ethoxyphenyl)-5-{[4-hydroxy-3-(prop-2-en-1-yl)phenyl]methylidene}-1,3-diazinane-2,4,6-trione
5609-0409 Screening compound: (5Z)-1-(4-ethoxyphenyl)-5-{[4-hydroxy-3-(prop-2-en-1-yl)phenyl]methylidene}-1,3-diazinane-2,4,6-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound 5609-0409
(5Z)-1-(4-ethoxyphenyl)-5-{[4-hydroxy-3-(prop-2-en-1-yl)phenyl]methylidene}-1,3-diazinane-2,4,6-trione

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

5609-0409

Molecular Formula

C22H20N2O5 (C22 H20 N2 O5)

Compound Name

(5Z)-1-(4-ethoxyphenyl)-5-{[4-hydroxy-3-(prop-2-en-1-yl)phenyl]methylidene}-1,3-diazinane-2,4,6-trione

IUPAC name

(5Z)-1-(4-ethoxyphenyl)-5-{[4-hydroxy-3-(prop-2-en-1-yl)phenyl]methylidene}-13-diazinane-246-trione

SMILES

CCOc(cc1)ccc1N(C(/C(/C(N1)=O)=C\c(cc2)cc(CC=C)c2O)=O)C1=O

InChI

InChI=1S/C22H20N2O5/c1-3-5-15-12-14(6-11-19(15)25)13-18-20(26)23-22(28)24(21(18)27)16-7-9-17(10-8-16)29-4-2/h3,6-13,25H,1,4-5H2,2H3,(H,23,26,28)

InChI Key

MANHGENPWJYTJR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03175551

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.140

Distribution Coefficient, logD

2.837

Water Solubility, LogSw

-3.19

Polar Surface Area

77.062

Acid Dissociation Constant (pKa)

7.40

Base Dissociation Constant (pKb)

-5.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

5609-0409 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 5609-0409 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5609-0409?
Check Price and Availability of 5609-0409, 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 5609-0409 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5609-0409
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5609-0409
  • 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 5609-0409 available by request