8019-7291 Screening compound: N'-[(E)-(4,7-dimethoxy-6-propyl-2H-1,3-benzodioxol-5-yl)methylidene]-5-fluoro-1H-indole-2-carbohydrazide

8019-7291 Screening compound: N'-[(E)-(4,7-dimethoxy-6-propyl-2H-1,3-benzodioxol-5-yl)methylidene]-5-fluoro-1H-indole-2-carbohydrazide
8019-7291 Screening compound: N'-[(E)-(4,7-dimethoxy-6-propyl-2H-1,3-benzodioxol-5-yl)methylidene]-5-fluoro-1H-indole-2-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-7291
N'-[(E)-(4,7-dimethoxy-6-propyl-2H-1,3-benzodioxol-5-yl)methylidene]-5-fluoro-1H-indole-2-carbohydrazide

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

8019-7291

Molecular Formula

C22H22FN3O5 (C22 H22 FN3 O5)

Compound Name

N'-[(E)-(4,7-dimethoxy-6-propyl-2H-1,3-benzodioxol-5-yl)methylidene]-5-fluoro-1H-indole-2-carbohydrazide

IUPAC name

N'-[(E)-(47-dimethoxy-6-propyl-2H-13-benzodioxol-5-yl)methylidene]-5-fluoro-1H-indole-2-carbohydrazide

SMILES

CCCc(c(/C=N/NC(c1cc(cc(cc2)F)c2[nH]1)=O)c(c1c2OCO1)OC)c2OC

InChI

InChI=1S/C22H22FN3O5/c1-4-5-14-15(19(29-3)21-20(18(14)28-2)30-11-31-21)10-24-26-22(27)17-9-12-8-13(23)6-7-16(12)25-17/h6-10,25H,4-5,11H2,1-3H3,(H,26,27)

InChI Key

JUKHKGUDSKYEQV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10039246

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.471

Distribution Coefficient, logD

5.471

Water Solubility, LogSw

-5.63

Polar Surface Area

76.821

Acid Dissociation Constant (pKa)

10.73

Base Dissociation Constant (pKb)

1.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

8019-7291 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8019-7291 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-7291?
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What is the minimum amount of 8019-7291 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-7291
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-7291
  • 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 8019-7291 available by request