2897-0559 Screening compound: (5E)-5-[(3,5-diiodo-4-methoxyphenyl)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione

2897-0559 Screening compound: (5E)-5-[(3,5-diiodo-4-methoxyphenyl)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione
2897-0559 Screening compound: (5E)-5-[(3,5-diiodo-4-methoxyphenyl)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione alternative view

Chemical Structure Depiction of ChemDiv screening compound 2897-0559
(5E)-5-[(3,5-diiodo-4-methoxyphenyl)methylidene]-1-(4-methoxyphenyl)-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

2897-0559

Molecular Formula

C19H14I2N2O5 (C19 H14 I2 N2 O5)

Compound Name

(5E)-5-[(3,5-diiodo-4-methoxyphenyl)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione

IUPAC name

(5E)-5-[(35-diiodo-4-methoxyphenyl)methylidene]-1-(4-methoxyphenyl)-13-diazinane-246-trione

SMILES

COc(cc1)ccc1N(C(/C(/C(N1)=O)=C/c(cc2I)cc(I)c2OC)=O)C1=O

InChI

InChI=1S/C19H14I2N2O5/c1-27-12-5-3-11(4-6-12)23-18(25)13(17(24)22-19(23)26)7-10-8-14(20)16(28-2)15(21)9-10/h3-9H,1-2H3,(H,22,24,26)

InChI Key

ZYPSNMHUSFGGSF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02085102

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

604.14

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.062

Distribution Coefficient, logD

3.759

Water Solubility, LogSw

-4.27

Polar Surface Area

68.652

Acid Dissociation Constant (pKa)

7.40

Base Dissociation Constant (pKb)

-5.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

References: we are preparing a list of scientific research reports with 2897-0559 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2897-0559?
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What is the minimum amount of 2897-0559 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2897-0559
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2897-0559
  • 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 2897-0559 available by request