D335-0257 Screening compound: N-{[1-(dimethylamino)cyclohexyl]methyl}-4-methoxybenzamide

D335-0257 Screening compound: N-{[1-(dimethylamino)cyclohexyl]methyl}-4-methoxybenzamide
D335-0257 Screening compound: N-{[1-(dimethylamino)cyclohexyl]methyl}-4-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D335-0257
N-{[1-(dimethylamino)cyclohexyl]methyl}-4-methoxybenzamide

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

D335-0257

Molecular Formula

C17H26N2O2 (C17 H26 N2 O2)

Compound Name

N-{[1-(dimethylamino)cyclohexyl]methyl}-4-methoxybenzamide

IUPAC name

N-{[1-(dimethylamino)cyclohexyl]methyl}-4-methoxybenzamide

SMILES

CN(C)C1(CNC(c(cc2)ccc2OC)=O)CCCCC1

InChI

InChI=1S/C17H26N2O2/c1-19(2)17(11-5-4-6-12-17)13-18-16(20)14-7-9-15(21-3)10-8-14/h7-10H,4-6,11-13H2,1-3H3,(H,18,20)

InChI Key

JMTHOIGGAHWQJU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06378748

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

290.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.807

Distribution Coefficient, logD

2.018

Water Solubility, LogSw

-3.24

Polar Surface Area

34.781

Acid Dissociation Constant (pKa)

12.27

Base Dissociation Constant (pKb)

8.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.80

D335-0257 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CNS BBB Library (22607 compounds)

Dark Chemical Matter Library (18430 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with D335-0257 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D335-0257?
Check Price and Availability of D335-0257, 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 D335-0257 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D335-0257
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D335-0257
  • 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 D335-0257 available by request