8009-1633 Screening compound: N'-[(E)-amino({[1-(3-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl})methylidene]acetohydrazide

8009-1633 Screening compound: N'-[(E)-amino({[1-(3-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl})methylidene]acetohydrazide
8009-1633 Screening compound: N'-[(E)-amino({[1-(3-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl})methylidene]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-1633
N'-[(E)-amino({[1-(3-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl})methylidene]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

8009-1633

Molecular Formula

C15H18N4O4S (C15 H18 N4 O4 S)

Compound Name

N'-[(E)-amino({[1-(3-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl})methylidene]acetohydrazide

IUPAC name

N'-[(E)-amino({[1-(3-ethoxyphenyl)-25-dioxopyrrolidin-3-yl]sulfanyl})methylidene]acetohydrazide

SMILES

CCOc1cccc(N(C(CC2S/C(/N)=N/NC(C)=O)=O)C2=O)c1

InChI

InChI=1S/C15H18N4O4S/c1-3-23-11-6-4-5-10(7-11)19-13(21)8-12(14(19)22)24-15(16)18-17-9(2)20/h4-7,12H,3,8H2,1-2H3,(H2,16,18)(H,17,20)/t12-/m0/s1

InChI Key

CPWFWCNDJMRGBG-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD01461663

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.4

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.539

Distribution Coefficient, logD

0.520

Water Solubility, LogSw

-2.19

Polar Surface Area

92.075

Acid Dissociation Constant (pKa)

8.76

Base Dissociation Constant (pKb)

2.59

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

8009-1633 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 8009-1633 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-1633?
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What is the minimum amount of 8009-1633 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-1633
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-1633
  • 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 8009-1633 available by request