2066-0001 Screening compound: N'-[(2Z)-1-(2,5-dioxopyrrolidin-1-yl)propan-2-ylidene]-4-nitrobenzohydrazide

2066-0001 Screening compound: N'-[(2Z)-1-(2,5-dioxopyrrolidin-1-yl)propan-2-ylidene]-4-nitrobenzohydrazide
2066-0001 Screening compound: N'-[(2Z)-1-(2,5-dioxopyrrolidin-1-yl)propan-2-ylidene]-4-nitrobenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2066-0001
N'-[(2Z)-1-(2,5-dioxopyrrolidin-1-yl)propan-2-ylidene]-4-nitrobenzohydrazide

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

2066-0001

Molecular Formula

C14H14N4O5 (C14 H14 N4 O5)

Compound Name

N'-[(2Z)-1-(2,5-dioxopyrrolidin-1-yl)propan-2-ylidene]-4-nitrobenzohydrazide

IUPAC name

N'-[(2Z)-1-(25-dioxopyrrolidin-1-yl)propan-2-ylidene]-4-nitrobenzohydrazide

SMILES

C/C(/CN(C(CC1)=O)C1=O)=N/NC(c(cc1)ccc1[N+]([O-])=O)=O

InChI

InChI=1S/C14H14N4O5/c1-9(8-17-12(19)6-7-13(17)20)15-16-14(21)10-2-4-11(5-3-10)18(22)23/h2-5H,6-8H2,1H3,(H,16,21)

InChI Key

LIMHDXZGEVPVQI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00749941

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

318.29

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.345

Distribution Coefficient, logD

0.324

Water Solubility, LogSw

-2.05

Polar Surface Area

98.656

Acid Dissociation Constant (pKa)

8.70

Base Dissociation Constant (pKb)

1.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with 2066-0001 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2066-0001?
Check Price and Availability of 2066-0001, 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 2066-0001 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2066-0001
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2066-0001
  • 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 2066-0001 available by request