1936-2279 Screening compound: N-[(1Z)-1-{N'-[(E)-(5-bromo-2-methoxyphenyl)methylidene]hydrazinecarbonyl}-2-[4-(dimethylamino)phenyl]eth-1-en-1-yl]benzamide

1936-2279 Screening compound: N-[(1Z)-1-{N'-[(E)-(5-bromo-2-methoxyphenyl)methylidene]hydrazinecarbonyl}-2-[4-(dimethylamino)phenyl]eth-1-en-1-yl]benzamide
1936-2279 Screening compound: N-[(1Z)-1-{N'-[(E)-(5-bromo-2-methoxyphenyl)methylidene]hydrazinecarbonyl}-2-[4-(dimethylamino)phenyl]eth-1-en-1-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1936-2279
N-[(1Z)-1-{N'-[(E)-(5-bromo-2-methoxyphenyl)methylidene]hydrazinecarbonyl}-2-[4-(dimethylamino)phenyl]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

1936-2279

Molecular Formula

C26H25BrN4O3 (C26 H25 BrN4 O3)

Compound Name

N-[(1Z)-1-{N'-[(E)-(5-bromo-2-methoxyphenyl)methylidene]hydrazinecarbonyl}-2-[4-(dimethylamino)phenyl]eth-1-en-1-yl]benzamide

IUPAC name

N-[(1Z)-1-{N'-[(E)-(5-bromo-2-methoxyphenyl)methylidene]hydrazinecarbonyl}-2-[4-(dimethylamino)phenyl]eth-1-en-1-yl]benzamide

SMILES

CN(C)c1ccc(/C=C(/C(N/N=C/c(cc(cc2)Br)c2OC)=O)\NC(c2ccccc2)=O)cc1

InChI

InChI=1S/C26H25BrN4O3/c1-31(2)22-12-9-18(10-13-22)15-23(29-25(32)19-7-5-4-6-8-19)26(33)30-28-17-20-16-21(27)11-14-24(20)34-3/h4-17H,1-3H3,(H,29,32)(H,30,33)

InChI Key

HOBQBOHSCZDEMA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01839403

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

521.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.373

Distribution Coefficient, logD

3.499

Water Solubility, LogSw

-5.47

Polar Surface Area

67.914

Acid Dissociation Constant (pKa)

5.53

Base Dissociation Constant (pKb)

4.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.50

1936-2279 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 1936-2279 chemical compound. It will be published here after verification.

Frequently Asked Questions

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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1936-2279
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1936-2279
  • 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 1936-2279 available by request