D218-0072 Screening compound: N-[2-(4-methoxyphenyl)-2-(pyrrolidin-1-yl)ethyl]-2-methylpropanamide

D218-0072 Screening compound: N-[2-(4-methoxyphenyl)-2-(pyrrolidin-1-yl)ethyl]-2-methylpropanamide
D218-0072 Screening compound: N-[2-(4-methoxyphenyl)-2-(pyrrolidin-1-yl)ethyl]-2-methylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D218-0072
N-[2-(4-methoxyphenyl)-2-(pyrrolidin-1-yl)ethyl]-2-methylpropanamide

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

D218-0072

Molecular Formula

C17H26N2O2 (C17 H26 N2 O2)

Compound Name

N-[2-(4-methoxyphenyl)-2-(pyrrolidin-1-yl)ethyl]-2-methylpropanamide

IUPAC name

N-[2-(4-methoxyphenyl)-2-(pyrrolidin-1-yl)ethyl]-2-methylpropanamide

SMILES

CC(C)C(NCC(c(cc1)ccc1OC)N1CCCC1)=O

InChI

InChI=1S/C17H26N2O2/c1-13(2)17(20)18-12-16(19-10-4-5-11-19)14-6-8-15(21-3)9-7-14/h6-9,13,16H,4-5,10-12H2,1-3H3,(H,18,20)/t16-/m0/s1

InChI Key

LSVPMIPQKKBZMF-INIZCTEOSA-N

MDL Number (MFCD)

MFCD12333098

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

290.41

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

2.420

Distribution Coefficient, logD

1.513

Water Solubility, LogSw

-2.73

Polar Surface Area

35.822

Acid Dissociation Constant (pKa)

13.01

Base Dissociation Constant (pKb)

8.25

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

58.80

D218-0072 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with D218-0072 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D218-0072?
Check Price and Availability of D218-0072, 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 D218-0072 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D218-0072
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D218-0072
  • 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 D218-0072 available by request