2410-0198 Screening compound: N-[(1E)-1-{N'-[(E)-(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinecarbonyl}-2-(4-methoxyphenyl)eth-1-en-1-yl]benzamide

2410-0198 Screening compound: N-[(1E)-1-{N'-[(E)-(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinecarbonyl}-2-(4-methoxyphenyl)eth-1-en-1-yl]benzamide
2410-0198 Screening compound: N-[(1E)-1-{N'-[(E)-(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinecarbonyl}-2-(4-methoxyphenyl)eth-1-en-1-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2410-0198
N-[(1E)-1-{N'-[(E)-(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinecarbonyl}-2-(4-methoxyphenyl)eth-1-en-1-yl]benzamide

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

2410-0198

Molecular Formula

C25H21N3O5 (C25 H21 N3 O5)

Compound Name

N-[(1E)-1-{N'-[(E)-(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinecarbonyl}-2-(4-methoxyphenyl)eth-1-en-1-yl]benzamide

IUPAC name

N-[(1E)-1-{N'-[(E)-(2H-13-benzodioxol-5-yl)methylidene]hydrazinecarbonyl}-2-(4-methoxyphenyl)eth-1-en-1-yl]benzamide

SMILES

COc1ccc(/C=C(\C(N/N=C/c(cc2)cc3c2OCO3)=O)/NC(c2ccccc2)=O)cc1

InChI

InChI=1S/C25H21N3O5/c1-31-20-10-7-17(8-11-20)13-21(27-24(29)19-5-3-2-4-6-19)25(30)28-26-15-18-9-12-22-23(14-18)33-16-32-22/h2-15H,16H2,1H3,(H,27,29)(H,28,30)

InChI Key

GSXQRFZTQIZNIW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01028838

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.139

Distribution Coefficient, logD

2.264

Water Solubility, LogSw

-4.33

Polar Surface Area

82.138

Acid Dissociation Constant (pKa)

5.53

Base Dissociation Constant (pKb)

4.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.00

2410-0198 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 2410-0198 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2410-0198?
Check Price and Availability of 2410-0198, 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 2410-0198 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2410-0198
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2410-0198
  • 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 2410-0198 available by request