4169-2543 Screening compound: 4-amino-N-{2-[(2-chloro-4-nitrophenyl)amino]ethyl}-1,2,5-oxadiazole-3-carboxamide

4169-2543 Screening compound: 4-amino-N-{2-[(2-chloro-4-nitrophenyl)amino]ethyl}-1,2,5-oxadiazole-3-carboxamide
4169-2543 Screening compound: 4-amino-N-{2-[(2-chloro-4-nitrophenyl)amino]ethyl}-1,2,5-oxadiazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4169-2543
4-amino-N-{2-[(2-chloro-4-nitrophenyl)amino]ethyl}-1,2,5-oxadiazole-3-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

4169-2543

Molecular Formula

C11H11ClN6O4 (C11 H11 ClN6 O4)

Compound Name

4-amino-N-{2-[(2-chloro-4-nitrophenyl)amino]ethyl}-1,2,5-oxadiazole-3-carboxamide

IUPAC name

4-amino-N-{2-[(2-chloro-4-nitrophenyl)amino]ethyl}-125-oxadiazole-3-carboxamide

SMILES

Nc1nonc1C(NCCNc(ccc([N+]([O-])=O)c1)c1Cl)=O

InChI

InChI=1S/C11H11ClN6O4/c12-7-5-6(18(20)21)1-2-8(7)14-3-4-15-11(19)9-10(13)17-22-16-9/h1-2,5,14H,3-4H2,(H2,13,17)(H,15,19)

InChI Key

HGAWDDNIERUUJY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00640793

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.7

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.514

Distribution Coefficient, logD

1.514

Water Solubility, LogSw

-2.66

Polar Surface Area

124.610

Acid Dissociation Constant (pKa)

14.29

Base Dissociation Constant (pKb)

-1.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

References: we are preparing a list of scientific research reports with 4169-2543 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4169-2543?
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What is the minimum amount of 4169-2543 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4169-2543
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4169-2543
  • 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 4169-2543 available by request