2159-4169 Screening compound: 3-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino]-N'-[(E)-(4-methoxyphenyl)methylidene]propanehydrazide

2159-4169 Screening compound: 3-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino]-N'-[(E)-(4-methoxyphenyl)methylidene]propanehydrazide
2159-4169 Screening compound: 3-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino]-N'-[(E)-(4-methoxyphenyl)methylidene]propanehydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2159-4169
3-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino]-N'-[(E)-(4-methoxyphenyl)methylidene]propanehydrazide

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

2159-4169

Molecular Formula

C14H16N6O4 (C14 H16 N6 O4)

Compound Name

3-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)amino]-N'-[(E)-(4-methoxyphenyl)methylidene]propanehydrazide

IUPAC name

3-[(35-dioxo-2345-tetrahydro-124-triazin-6-yl)amino]-N'-[(E)-(4-methoxyphenyl)methylidene]propanehydrazide

SMILES

COc1ccc(/C=N/NC(CCNC(C(N2)=O)=NNC2=O)=O)cc1

InChI

InChI=1S/C14H16N6O4/c1-24-10-4-2-9(3-5-10)8-16-18-11(21)6-7-15-12-13(22)17-14(23)20-19-12/h2-5,8H,6-7H2,1H3,(H,15,19)(H,18,21)(H2,17,20,22,23)

InChI Key

NYAOANBHHRTQBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01184983

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.32

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-0.444

Distribution Coefficient, logD

-2.107

Water Solubility, LogSw

-1.78

Polar Surface Area

115.472

Acid Dissociation Constant (pKa)

5.75

Base Dissociation Constant (pKb)

5.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

2159-4169 in Drug Discovery

Included in Screening Libraries

RNA-Protein Interaction Inhibitors Library (1986 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 2159-4169 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2159-4169?
Check Price and Availability of 2159-4169, 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 2159-4169 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2159-4169
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2159-4169
  • 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 2159-4169 available by request