C284-0314 Screening compound: N-(2,4-dimethoxyphenyl)-2-(2-{[(4-fluorophenyl)methyl]amino}acetamido)-5-nitrobenzamide

C284-0314 Screening compound: N-(2,4-dimethoxyphenyl)-2-(2-{[(4-fluorophenyl)methyl]amino}acetamido)-5-nitrobenzamide
C284-0314 Screening compound: N-(2,4-dimethoxyphenyl)-2-(2-{[(4-fluorophenyl)methyl]amino}acetamido)-5-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C284-0314
N-(2,4-dimethoxyphenyl)-2-(2-{[(4-fluorophenyl)methyl]amino}acetamido)-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

C284-0314

Molecular Formula

C24H23FN4O6 (C24 H23 FN4 O6)

Compound Name

N-(2,4-dimethoxyphenyl)-2-(2-{[(4-fluorophenyl)methyl]amino}acetamido)-5-nitrobenzamide

IUPAC name

N-(24-dimethoxyphenyl)-2-(2-{[(4-fluorophenyl)methyl]amino}acetamido)-5-nitrobenzamide

SMILES

COc(cc1)cc(OC)c1NC(c(cc(cc1)[N+]([O-])=O)c1NC(CNCc(cc1)ccc1F)=O)=O

InChI

InChI=1S/C24H23FN4O6/c1-34-18-8-10-21(22(12-18)35-2)28-24(31)19-11-17(29(32)33)7-9-20(19)27-23(30)14-26-13-15-3-5-16(25)6-4-15/h3-12,26H,13-14H2,1-2H3,(H,27,30)(H,28,31)

InChI Key

YUMYSOPFBNDJQK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14740788

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

482.47

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.956

Distribution Coefficient, logD

2.718

Water Solubility, LogSw

-3.52

Polar Surface Area

105.405

Acid Dissociation Constant (pKa)

7.55

Base Dissociation Constant (pKb)

5.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

C284-0314 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C284-0314 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C284-0314?
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What is the minimum amount of C284-0314 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C284-0314
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C284-0314
  • 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 C284-0314 available by request