C284-0460 Screening compound: 2-[2-(cyclohexylamino)acetamido]-N-(2-fluorophenyl)-5-nitrobenzamide

C284-0460 Screening compound: 2-[2-(cyclohexylamino)acetamido]-N-(2-fluorophenyl)-5-nitrobenzamide
C284-0460 Screening compound: 2-[2-(cyclohexylamino)acetamido]-N-(2-fluorophenyl)-5-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C284-0460
2-[2-(cyclohexylamino)acetamido]-N-(2-fluorophenyl)-5-nitrobenzamide

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

C284-0460

Molecular Formula

C21H23FN4O4 (C21 H23 FN4 O4)

Compound Name

2-[2-(cyclohexylamino)acetamido]-N-(2-fluorophenyl)-5-nitrobenzamide

IUPAC name

2-[2-(cyclohexylamino)acetamido]-N-(2-fluorophenyl)-5-nitrobenzamide

SMILES

[O-][N+](c(cc1)cc(C(Nc(cccc2)c2F)=O)c1NC(CNC1CCCCC1)=O)=O

InChI

InChI=1S/C21H23FN4O4/c22-17-8-4-5-9-19(17)25-21(28)16-12-15(26(29)30)10-11-18(16)24-20(27)13-23-14-6-2-1-3-7-14/h4-5,8-12,14,23H,1-3,6-7,13H2,(H,24,27)(H,25,28)

InChI Key

SLGDLNKRQOSCDZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14740823

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.44

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.170

Distribution Coefficient, logD

2.981

Water Solubility, LogSw

-3.65

Polar Surface Area

89.747

Acid Dissociation Constant (pKa)

7.87

Base Dissociation Constant (pKb)

7.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

C284-0460 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

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 C284-0460 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C284-0460?
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What is the minimum amount of C284-0460 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C284-0460
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C284-0460
  • 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 C284-0460 available by request