D491-7588 Screening compound: N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-phenylacetamide

D491-7588 Screening compound: N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-phenylacetamide
D491-7588 Screening compound: N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D491-7588
N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-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

D491-7588

Molecular Formula

C21H28N2O2 (C21 H28 N2 O2)

Compound Name

N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-phenylacetamide

IUPAC name

N-[2-(5-methylfuran-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-phenylacetamide

SMILES

CC(CC1)CCN1C(CNC(Cc1ccccc1)=O)c1ccc(C)o1

InChI

InChI=1S/C21H28N2O2/c1-16-10-12-23(13-11-16)19(20-9-8-17(2)25-20)15-22-21(24)14-18-6-4-3-5-7-18/h3-9,16,19H,10-15H2,1-2H3,(H,22,24)/t19-/m0/s1

InChI Key

TVXKXXZYVBIVEM-IBGZPJMESA-N

MDL Number (MFCD)

MFCD14832680

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

340.47

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.360

Distribution Coefficient, logD

2.281

Water Solubility, LogSw

-3.53

Polar Surface Area

35.520

Acid Dissociation Constant (pKa)

12.77

Base Dissociation Constant (pKb)

8.44

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

47.60

D491-7588 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with D491-7588 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D491-7588?
Check Price and Availability of D491-7588, 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 D491-7588 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D491-7588
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D491-7588
  • 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 D491-7588 available by request