8001-7160 Screening compound: N-[(1E)-2-(2,4-dimethoxyphenyl)-1-{N'-[(E)-(2-methoxy-5-nitrophenyl)methylidene]hydrazinecarbonyl}eth-1-en-1-yl]benzamide

8001-7160 Screening compound: N-[(1E)-2-(2,4-dimethoxyphenyl)-1-{N'-[(E)-(2-methoxy-5-nitrophenyl)methylidene]hydrazinecarbonyl}eth-1-en-1-yl]benzamide
8001-7160 Screening compound: N-[(1E)-2-(2,4-dimethoxyphenyl)-1-{N'-[(E)-(2-methoxy-5-nitrophenyl)methylidene]hydrazinecarbonyl}eth-1-en-1-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8001-7160
N-[(1E)-2-(2,4-dimethoxyphenyl)-1-{N'-[(E)-(2-methoxy-5-nitrophenyl)methylidene]hydrazinecarbonyl}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

8001-7160

Molecular Formula

C26H24N4O7 (C26 H24 N4 O7)

Compound Name

N-[(1E)-2-(2,4-dimethoxyphenyl)-1-{N'-[(E)-(2-methoxy-5-nitrophenyl)methylidene]hydrazinecarbonyl}eth-1-en-1-yl]benzamide

IUPAC name

N-[(1E)-2-(24-dimethoxyphenyl)-1-{N'-[(E)-(2-methoxy-5-nitrophenyl)methylidene]hydrazinecarbonyl}eth-1-en-1-yl]benzamide

SMILES

COc1cc(OC)c(/C=C(\C(N/N=C/c(cc(cc2)[N+]([O-])=O)c2OC)=O)/NC(c2ccccc2)=O)cc1

InChI

InChI=1S/C26H24N4O7/c1-35-21-11-9-18(24(15-21)37-3)14-22(28-25(31)17-7-5-4-6-8-17)26(32)29-27-16-19-13-20(30(33)34)10-12-23(19)36-2/h4-16H,1-3H3,(H,28,31)(H,29,32)

InChI Key

QHDPDPYCASBBAM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00732113

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

504.5

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

4.646

Distribution Coefficient, logD

3.362

Water Solubility, LogSw

-4.55

Polar Surface Area

113.665

Acid Dissociation Constant (pKa)

6.14

Base Dissociation Constant (pKb)

4.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.50

8001-7160 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 8001-7160 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8001-7160?
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What is the minimum amount of 8001-7160 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8001-7160
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8001-7160
  • 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 8001-7160 available by request