1359-0167 Screening compound: N-({N'-[(E)-(3-ethoxy-2-hydroxy-5-nitrophenyl)methylidene]hydrazinecarbonyl}methyl)pyridine-4-carboxamide

1359-0167 Screening compound: N-({N'-[(E)-(3-ethoxy-2-hydroxy-5-nitrophenyl)methylidene]hydrazinecarbonyl}methyl)pyridine-4-carboxamide
1359-0167 Screening compound: N-({N'-[(E)-(3-ethoxy-2-hydroxy-5-nitrophenyl)methylidene]hydrazinecarbonyl}methyl)pyridine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1359-0167
N-({N'-[(E)-(3-ethoxy-2-hydroxy-5-nitrophenyl)methylidene]hydrazinecarbonyl}methyl)pyridine-4-carboxamide

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

1359-0167

Molecular Formula

C17H17N5O6 (C17 H17 N5 O6)

Compound Name

N-({N'-[(E)-(3-ethoxy-2-hydroxy-5-nitrophenyl)methylidene]hydrazinecarbonyl}methyl)pyridine-4-carboxamide

IUPAC name

N-({N'-[(E)-(3-ethoxy-2-hydroxy-5-nitrophenyl)methylidene]hydrazinecarbonyl}methyl)pyridine-4-carboxamide

SMILES

CCOc(cc(cc1/C=N/NC(CNC(c2ccncc2)=O)=O)[N+]([O-])=O)c1O

InChI

InChI=1S/C17H17N5O6/c1-2-28-14-8-13(22(26)27)7-12(16(14)24)9-20-21-15(23)10-19-17(25)11-3-5-18-6-4-11/h3-9,24H,2,10H2,1H3,(H,19,25)(H,21,23)

InChI Key

OEFHWDGGWRPKCS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00352380

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.35

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

1.601

Distribution Coefficient, logD

0.996

Water Solubility, LogSw

-1.77

Polar Surface Area

125.525

Acid Dissociation Constant (pKa)

6.92

Base Dissociation Constant (pKb)

4.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

1359-0167 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1359-0167 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1359-0167?
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What is the minimum amount of 1359-0167 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1359-0167
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1359-0167
  • 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 1359-0167 available by request