1805-1363 Screening compound: N-({N'-[(E)-(5-nitrothiophen-2-yl)methylidene]hydrazinecarbonyl}methyl)-2-phenylacetamide

1805-1363 Screening compound: N-({N'-[(E)-(5-nitrothiophen-2-yl)methylidene]hydrazinecarbonyl}methyl)-2-phenylacetamide
1805-1363 Screening compound: N-({N'-[(E)-(5-nitrothiophen-2-yl)methylidene]hydrazinecarbonyl}methyl)-2-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1805-1363
N-({N'-[(E)-(5-nitrothiophen-2-yl)methylidene]hydrazinecarbonyl}methyl)-2-phenylacetamide

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

1805-1363

Molecular Formula

C15H14N4O4S (C15 H14 N4 O4 S)

Compound Name

N-({N'-[(E)-(5-nitrothiophen-2-yl)methylidene]hydrazinecarbonyl}methyl)-2-phenylacetamide

IUPAC name

N-({N'-[(E)-(5-nitrothiophen-2-yl)methylidene]hydrazinecarbonyl}methyl)-2-phenylacetamide

SMILES

[O-][N+](c1ccc(/C=N/NC(CNC(Cc2ccccc2)=O)=O)s1)=O

InChI

InChI=1S/C15H14N4O4S/c20-13(8-11-4-2-1-3-5-11)16-10-14(21)18-17-9-12-6-7-15(24-12)19(22)23/h1-7,9H,8,10H2,(H,16,20)(H,18,21)

InChI Key

FGXSOUCVABTVND-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01147229

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.37

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.515

Distribution Coefficient, logD

2.515

Water Solubility, LogSw

-2.70

Polar Surface Area

94.564

Acid Dissociation Constant (pKa)

11.63

Base Dissociation Constant (pKb)

0.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

1805-1363 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 1805-1363 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1805-1363?
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What is the minimum amount of 1805-1363 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1805-1363
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1805-1363
  • 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 1805-1363 available by request