D335-0336 Screening compound: N-{[1-(dimethylamino)cyclohexyl]methyl}-2-phenylacetamide

D335-0336 Screening compound: N-{[1-(dimethylamino)cyclohexyl]methyl}-2-phenylacetamide
D335-0336 Screening compound: N-{[1-(dimethylamino)cyclohexyl]methyl}-2-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D335-0336
N-{[1-(dimethylamino)cyclohexyl]methyl}-2-phenylacetamide

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

D335-0336

Molecular Formula

C17H26N2O (C17 H26 N2 O)

Compound Name

N-{[1-(dimethylamino)cyclohexyl]methyl}-2-phenylacetamide

IUPAC name

N-{[1-(dimethylamino)cyclohexyl]methyl}-2-phenylacetamide

SMILES

CN(C)C1(CNC(Cc2ccccc2)=O)CCCCC1

InChI

InChI=1S/C17H26N2O/c1-19(2)17(11-7-4-8-12-17)14-18-16(20)13-15-9-5-3-6-10-15/h3,5-6,9-10H,4,7-8,11-14H2,1-2H3,(H,18,20)

InChI Key

DSUHTIZSVBBKID-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08547211

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

274.41

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.710

Distribution Coefficient, logD

1.154

Water Solubility, LogSw

-2.92

Polar Surface Area

27.024

Acid Dissociation Constant (pKa)

12.85

Base Dissociation Constant (pKb)

8.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.80

D335-0336 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
  • Nervous system
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with D335-0336 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D335-0336?
Check Price and Availability of D335-0336, 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 D335-0336 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D335-0336
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D335-0336
  • 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 D335-0336 available by request