0606-5830 Screening compound: 5-[(4-ethoxy-2-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione

0606-5830 Screening compound: 5-[(4-ethoxy-2-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
0606-5830 Screening compound: 5-[(4-ethoxy-2-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound 0606-5830
5-[(4-ethoxy-2-hydroxyphenyl)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

0606-5830

Molecular Formula

C13H12N2O5 (C13 H12 N2 O5)

Compound Name

5-[(4-ethoxy-2-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione

IUPAC name

5-[(4-ethoxy-2-hydroxyphenyl)methylidene]-13-diazinane-246-trione

SMILES

CCOc1cc(O)c(C=C(C(NC(N2)=O)=O)C2=O)cc1

InChI

InChI=1S/C13H12N2O5/c1-2-20-8-4-3-7(10(16)6-8)5-9-11(17)14-13(19)15-12(9)18/h3-6,16H,2H2,1H3,(H2,14,15,17,18,19)

InChI Key

GEKASQABADFABO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00989886

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

276.25

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.001

Distribution Coefficient, logD

0.795

Water Solubility, LogSw

-2.17

Polar Surface Area

86.315

Acid Dissociation Constant (pKa)

7.62

Base Dissociation Constant (pKb)

-7.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

References: we are preparing a list of scientific research reports with 0606-5830 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0606-5830?
Check Price and Availability of 0606-5830, 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 0606-5830 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0606-5830
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0606-5830
  • 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 0606-5830 available by request