3235-0275 Screening compound: N'-[(3Z)-1-[(azepan-1-yl)methyl]-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-{[(E)-[1-(3,4-dimethoxyphenyl)ethylidene]amino]oxy}acetohydrazide

3235-0275 Screening compound: N'-[(3Z)-1-[(azepan-1-yl)methyl]-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-{[(E)-[1-(3,4-dimethoxyphenyl)ethylidene]amino]oxy}acetohydrazide
3235-0275 Screening compound: N'-[(3Z)-1-[(azepan-1-yl)methyl]-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-{[(E)-[1-(3,4-dimethoxyphenyl)ethylidene]amino]oxy}acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3235-0275
N'-[(3Z)-1-[(azepan-1-yl)methyl]-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-{[(E)-[1-(3,4-dimethoxyphenyl)ethylidene]amino]oxy}acetohydrazide

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

3235-0275

Molecular Formula

C27H32BrN5O5 (C27 H32 BrN5 O5)

Compound Name

N'-[(3Z)-1-[(azepan-1-yl)methyl]-5-bromo-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-2-{[(E)-[1-(3,4-dimethoxyphenyl)ethylidene]amino]oxy}acetohydrazide

IUPAC name

N'-[(3Z)-1-[(azepan-1-yl)methyl]-5-bromo-2-oxo-23-dihydro-1H-indol-3-ylidene]-2-{[(E)-[1-(34-dimethoxyphenyl)ethylidene]amino]oxy}acetohydrazide

SMILES

C/C(/c(cc1)cc(OC)c1OC)=N\OCC(N/N=C(/c(cc(cc1)Br)c1N1CN2CCCCCC2)\C1=O)=O

InChI

InChI=1S/C27H32BrN5O5/c1-18(19-8-11-23(36-2)24(14-19)37-3)31-38-16-25(34)29-30-26-21-15-20(28)9-10-22(21)33(27(26)35)17-32-12-6-4-5-7-13-32/h8-11,14-15H,4-7,12-13,16-17H2,1-3H3,(H,29,34)

InChI Key

YPLMHEAZVXVOCV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01168527

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

586.49

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

4.981

Distribution Coefficient, logD

4.464

Water Solubility, LogSw

-4.54

Polar Surface Area

89.594

Acid Dissociation Constant (pKa)

8.78

Base Dissociation Constant (pKb)

7.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.70

3235-0275 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with 3235-0275 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3235-0275?
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What is the minimum amount of 3235-0275 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3235-0275
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3235-0275
  • 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 3235-0275 available by request