K087-0072 Screening compound: N'-[(E)-[3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methylidene]-4-methoxybenzohydrazide

K087-0072 Screening compound: N'-[(E)-[3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methylidene]-4-methoxybenzohydrazide
K087-0072 Screening compound: N'-[(E)-[3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methylidene]-4-methoxybenzohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound K087-0072
N'-[(E)-[3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methylidene]-4-methoxybenzohydrazide

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

K087-0072

Molecular Formula

C16H17N3O4 (C16 H17 N3 O4)

Compound Name

N'-[(E)-[3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methylidene]-4-methoxybenzohydrazide

IUPAC name

N'-[(E)-[3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methylidene]-4-methoxybenzohydrazide

SMILES

Cc1ncc(CO)c(/C=N/NC(c(cc2)ccc2OC)=O)c1O

InChI

InChI=1S/C16H17N3O4/c1-10-15(21)14(12(9-20)7-17-10)8-18-19-16(22)11-3-5-13(23-2)6-4-11/h3-8,20-21H,9H2,1-2H3,(H,19,22)

InChI Key

CLGBVQWRRPVQPL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01538969

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.33

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.245

Distribution Coefficient, logD

2.215

Water Solubility, LogSw

-2.43

Polar Surface Area

85.407

Acid Dissociation Constant (pKa)

8.56

Base Dissociation Constant (pKb)

4.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

K087-0072 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 K087-0072 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K087-0072?
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What is the minimum amount of K087-0072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K087-0072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K087-0072
  • 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 K087-0072 available by request