8018-1953 Screening compound: N-(4-fluorophenyl)-1-methyl-4-nitro-1H-imidazole-5-carboxamide

8018-1953 Screening compound: N-(4-fluorophenyl)-1-methyl-4-nitro-1H-imidazole-5-carboxamide
8018-1953 Screening compound: N-(4-fluorophenyl)-1-methyl-4-nitro-1H-imidazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-1953
N-(4-fluorophenyl)-1-methyl-4-nitro-1H-imidazole-5-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

8018-1953

Molecular Formula

C11H9FN4O3 (C11 H9 FN4 O3)

Compound Name

N-(4-fluorophenyl)-1-methyl-4-nitro-1H-imidazole-5-carboxamide

IUPAC name

N-(4-fluorophenyl)-1-methyl-4-nitro-1H-imidazole-5-carboxamide

SMILES

Cn(cn1)c(C(Nc(cc2)ccc2F)=O)c1[N+]([O-])=O

InChI

InChI=1S/C11H9FN4O3/c1-15-6-13-10(16(18)19)9(15)11(17)14-8-4-2-7(12)3-5-8/h2-6H,1H3,(H,14,17)

InChI Key

DMPZHZPYPVYKPG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07657193

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

264.22

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.268

Distribution Coefficient, logD

0.644

Water Solubility, LogSw

-2.23

Polar Surface Area

67.196

Acid Dissociation Constant (pKa)

6.89

Base Dissociation Constant (pKb)

-2.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

8018-1953 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8018-1953 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-1953?
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What is the minimum amount of 8018-1953 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-1953
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-1953
  • 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 8018-1953 available by request