0880-0233 Screening compound: 1-(2-hydroxyethyl)-3-{N'-[(E)-(4-nitrophenyl)methylidene]hydrazinecarbonyl}pyridin-1-ium

0880-0233 Screening compound: 1-(2-hydroxyethyl)-3-{N'-[(E)-(4-nitrophenyl)methylidene]hydrazinecarbonyl}pyridin-1-ium
0880-0233 Screening compound: 1-(2-hydroxyethyl)-3-{N'-[(E)-(4-nitrophenyl)methylidene]hydrazinecarbonyl}pyridin-1-ium alternative view

Chemical Structure Depiction of ChemDiv screening compound 0880-0233
1-(2-hydroxyethyl)-3-{N'-[(E)-(4-nitrophenyl)methylidene]hydrazinecarbonyl}pyridin-1-ium

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

0880-0233

Molecular Formula

C15H15N4O4 (C15 H15 N4 O4)

Compound Name

1-(2-hydroxyethyl)-3-{N'-[(E)-(4-nitrophenyl)methylidene]hydrazinecarbonyl}pyridin-1-ium

IUPAC name

n/a

SMILES

[O-][N+](c1ccc(/C=N/NC(c2c[n+](CCO)ccc2)=O)cc1)=O

InChI

InChI=1S/C15H14N4O4/c20-9-8-18-7-1-2-13(11-18)15(21)17-16-10-12-3-5-14(6-4-12)19(22)23/h1-7,10-11,20H,8-9H2/p+1

InChI Key

STWWJRWDOLJUMB-UHFFFAOYSA-O

MDL Number (MFCD)

MFCD00689454

Chemical and Physical Properties

Saltdata

Cl-

Molecular Weight

315.31

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.430

Distribution Coefficient, logD

1.417

Water Solubility, LogSw

-1.87

Polar Surface Area

88.527

Acid Dissociation Constant (pKa)

8.92

Base Dissociation Constant (pKb)

0.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

0880-0233 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 0880-0233 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0880-0233?
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What is the minimum amount of 0880-0233 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0880-0233
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0880-0233
  • 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 0880-0233 available by request