C281-0167 Screening compound: N-[2-(2-methyl-1H-indol-1-yl)ethyl]cyclohexanecarboxamide

C281-0167 Screening compound: N-[2-(2-methyl-1H-indol-1-yl)ethyl]cyclohexanecarboxamide
C281-0167 Screening compound: N-[2-(2-methyl-1H-indol-1-yl)ethyl]cyclohexanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C281-0167
N-[2-(2-methyl-1H-indol-1-yl)ethyl]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

C281-0167

Molecular Formula

C18H24N2O (C18 H24 N2 O)

Compound Name

N-[2-(2-methyl-1H-indol-1-yl)ethyl]cyclohexanecarboxamide

IUPAC name

N-[2-(2-methyl-1H-indol-1-yl)ethyl]cyclohexanecarboxamide

SMILES

Cc1cc(cccc2)c2n1CCNC(C1CCCCC1)=O

InChI

InChI=1S/C18H24N2O/c1-14-13-16-9-5-6-10-17(16)20(14)12-11-19-18(21)15-7-3-2-4-8-15/h5-6,9-10,13,15H,2-4,7-8,11-12H2,1H3,(H,19,21)

InChI Key

XGVRPQDHOVUGQI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04463381

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

284.4

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.768

Distribution Coefficient, logD

3.768

Water Solubility, LogSw

-3.82

Polar Surface Area

26.360

Acid Dissociation Constant (pKa)

13.74

Base Dissociation Constant (pKb)

-0.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

C281-0167 in Drug Discovery

Included in Screening Libraries

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

CNS targets activity set (6557 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 C281-0167 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C281-0167?
Check Price and Availability of C281-0167, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C281-0167 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C281-0167
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C281-0167
  • 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 C281-0167 available by request