8016-9632 Screening compound: N~1~-[2-(2-phenylacetyl)phenyl]-1-cyclohexanecarboxamide

8016-9632 Screening compound: N~1~-[2-(2-phenylacetyl)phenyl]-1-cyclohexanecarboxamide
8016-9632 Screening compound: N~1~-[2-(2-phenylacetyl)phenyl]-1-cyclohexanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8016-9632
N~1~-[2-(2-phenylacetyl)phenyl]-1-cyclohexanecarboxamide

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

8016-9632

Molecular Formula

C21H23NO2 (C21 H23 NO2)

Compound Name

N~1~-[2-(2-phenylacetyl)phenyl]-1-cyclohexanecarboxamide

IUPAC name

N-[2-(2-phenylacetyl)phenyl]cyclohexanecarboxamide

SMILES

O=C(Cc1ccccc1)c(cccc1)c1NC(C1CCCCC1)=O

InChI

InChI=1S/C21H23NO2/c23-20(15-16-9-3-1-4-10-16)18-13-7-8-14-19(18)22-21(24)17-11-5-2-6-12-17/h1,3-4,7-10,13-14,17H,2,5-6,11-12,15H2,(H,22,24)

InChI Key

ASMGQENQFLEXTN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05860628

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

321.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.373

Distribution Coefficient, logD

4.368

Water Solubility, LogSw

-4.53

Polar Surface Area

35.799

Acid Dissociation Constant (pKa)

9.32

Base Dissociation Constant (pKb)

-3.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

8016-9632 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

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

CORONAVIRUS Library (20774 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8016-9632 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8016-9632?
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What is the minimum amount of 8016-9632 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8016-9632
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8016-9632
  • 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 8016-9632 available by request