2066-0378 Screening compound: N-(4-{N'-[(E)-(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinecarbonyl}phenyl)-4-chlorobenzamide

2066-0378 Screening compound: N-(4-{N'-[(E)-(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinecarbonyl}phenyl)-4-chlorobenzamide
2066-0378 Screening compound: N-(4-{N'-[(E)-(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinecarbonyl}phenyl)-4-chlorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2066-0378
N-(4-{N'-[(E)-(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinecarbonyl}phenyl)-4-chlorobenzamide

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

2066-0378

Molecular Formula

C22H16ClN3O4 (C22 H16 ClN3 O4)

Compound Name

N-(4-{N'-[(E)-(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinecarbonyl}phenyl)-4-chlorobenzamide

IUPAC name

N-(4-{N'-[(E)-(2H-13-benzodioxol-5-yl)methylidene]hydrazinecarbonyl}phenyl)-4-chlorobenzamide

SMILES

O=C(c(cc1)ccc1Cl)Nc(cc1)ccc1C(N/N=C/c(cc1)cc2c1OCO2)=O

InChI

InChI=1S/C22H16ClN3O4/c23-17-6-2-15(3-7-17)21(27)25-18-8-4-16(5-9-18)22(28)26-24-12-14-1-10-19-20(11-14)30-13-29-19/h1-12H,13H2,(H,25,27)(H,26,28)

InChI Key

UQGWMMKZKBZFBS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01839583

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.84

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.454

Distribution Coefficient, logD

4.371

Water Solubility, LogSw

-4.91

Polar Surface Area

75.761

Acid Dissociation Constant (pKa)

8.08

Base Dissociation Constant (pKb)

0.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.50

References: we are preparing a list of scientific research reports with 2066-0378 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2066-0378?
Check Price and Availability of 2066-0378, 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 2066-0378 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2066-0378
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2066-0378
  • 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 2066-0378 available by request