1094-0125 Screening compound: N-benzyl-1-{N'-[(3Z)-2-oxo-1-(prop-2-en-1-yl)-2,3-dihydro-1H-indol-3-ylidene]hydrazinecarbonyl}formamide

1094-0125 Screening compound: N-benzyl-1-{N'-[(3Z)-2-oxo-1-(prop-2-en-1-yl)-2,3-dihydro-1H-indol-3-ylidene]hydrazinecarbonyl}formamide
1094-0125 Screening compound: N-benzyl-1-{N'-[(3Z)-2-oxo-1-(prop-2-en-1-yl)-2,3-dihydro-1H-indol-3-ylidene]hydrazinecarbonyl}formamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1094-0125
N-benzyl-1-{N'-[(3Z)-2-oxo-1-(prop-2-en-1-yl)-2,3-dihydro-1H-indol-3-ylidene]hydrazinecarbonyl}formamide

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

1094-0125

Molecular Formula

C20H18N4O3 (C20 H18 N4 O3)

Compound Name

N-benzyl-1-{N'-[(3Z)-2-oxo-1-(prop-2-en-1-yl)-2,3-dihydro-1H-indol-3-ylidene]hydrazinecarbonyl}formamide

IUPAC name

N-benzyl-1-{N'-[(3Z)-2-oxo-1-(prop-2-en-1-yl)-23-dihydro-1H-indol-3-ylidene]hydrazinecarbonyl}formamide

SMILES

C=CCN(c(cccc1)c1/C1=N/NC(C(NCc2ccccc2)=O)=O)C1=O

InChI

InChI=1S/C20H18N4O3/c1-2-12-24-16-11-7-6-10-15(16)17(20(24)27)22-23-19(26)18(25)21-13-14-8-4-3-5-9-14/h2-11H,1,12-13H2,(H,21,25)(H,23,26)

InChI Key

SPHCXSOYYMIDGE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00614495

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.242

Distribution Coefficient, logD

0.304

Water Solubility, LogSw

-2.97

Polar Surface Area

74.524

Acid Dissociation Constant (pKa)

5.47

Base Dissociation Constant (pKb)

1.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

References: we are preparing a list of scientific research reports with 1094-0125 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1094-0125?
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What is the minimum amount of 1094-0125 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1094-0125
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1094-0125
  • 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 1094-0125 available by request