1429-0019 Screening compound: 2-(4-METHOXYPHENOXY)-N'-[(E)-(6-NITRO-2H-1,3-BENZODIOXOL-5-YL)METHYLIDENE]ACETOHYDRAZIDE

1429-0019 Screening compound: 2-(4-METHOXYPHENOXY)-N'-[(E)-(6-NITRO-2H-1,3-BENZODIOXOL-5-YL)METHYLIDENE]ACETOHYDRAZIDE
1429-0019 Screening compound: 2-(4-METHOXYPHENOXY)-N'-[(E)-(6-NITRO-2H-1,3-BENZODIOXOL-5-YL)METHYLIDENE]ACETOHYDRAZIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound 1429-0019
2-(4-METHOXYPHENOXY)-N'-[(E)-(6-NITRO-2H-1,3-BENZODIOXOL-5-YL)METHYLIDENE]ACETOHYDRAZIDE

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

1429-0019

Molecular Formula

C17H15N3O7 (C17 H15 N3 O7)

Compound Name

2-(4-METHOXYPHENOXY)-N'-[(E)-(6-NITRO-2H-1,3-BENZODIOXOL-5-YL)METHYLIDENE]ACETOHYDRAZIDE

IUPAC name

n/a

SMILES

COc(cc1)ccc1OCC(N/N=C/c(cc1OCOc1c1)c1[N+]([O-])=O)=O

InChI

InChI=1S/C17H15N3O7/c1-24-12-2-4-13(5-3-12)25-9-17(21)19-18-8-11-6-15-16(27-10-26-15)7-14(11)20(22)23/h2-8H,9-10H2,1H3,(H,19,21)

InChI Key

XGHRBLKYJJNEGH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00808214

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.32

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.750

Distribution Coefficient, logD

2.748

Water Solubility, LogSw

-3.40

Polar Surface Area

100.580

Acid Dissociation Constant (pKa)

9.73

Base Dissociation Constant (pKb)

2.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

References: we are preparing a list of scientific research reports with 1429-0019 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1429-0019?
Check Price and Availability of 1429-0019, 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 1429-0019 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1429-0019
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1429-0019
  • 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 1429-0019 available by request