C582-0832 Screening compound: N,N-diethyl-5-methyl-4-nitro-1,2-oxazole-3-carboxamide

C582-0832 Screening compound: N,N-diethyl-5-methyl-4-nitro-1,2-oxazole-3-carboxamide
C582-0832 Screening compound: N,N-diethyl-5-methyl-4-nitro-1,2-oxazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C582-0832
N,N-diethyl-5-methyl-4-nitro-1,2-oxazole-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

C582-0832

Molecular Formula

C9H13N3O4 (C9 H13 N3 O4)

Compound Name

N,N-diethyl-5-methyl-4-nitro-1,2-oxazole-3-carboxamide

IUPAC name

NN-diethyl-5-methyl-4-nitro-12-oxazole-3-carboxamide

SMILES

CCN(CC)C(c1noc(C)c1[N+]([O-])=O)=O

InChI

InChI=1S/C9H13N3O4/c1-4-11(5-2)9(13)7-8(12(14)15)6(3)16-10-7/h4-5H2,1-3H3

InChI Key

VZLAEADMFINUMU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14772799

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

227.22

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.892

Distribution Coefficient, logD

0.892

Water Solubility, LogSw

-0.83

Polar Surface Area

71.182

Acid Dissociation Constant (pKa)

28.19

Base Dissociation Constant (pKb)

-2.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

55.60

C582-0832 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C582-0832 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C582-0832?
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What is the minimum amount of C582-0832 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C582-0832
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C582-0832
  • 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 C582-0832 available by request