D232-0618 Screening compound: N-[2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-3-methylbutanamide

D232-0618 Screening compound: N-[2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-3-methylbutanamide
D232-0618 Screening compound: N-[2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-3-methylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D232-0618
N-[2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-3-methylbutanamide

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

D232-0618

Molecular Formula

C16H26N2O2 (C16 H26 N2 O2)

Compound Name

N-[2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-3-methylbutanamide

IUPAC name

N-[2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-3-methylbutanamide

SMILES

CC(C)CC(NCC(c(cccc1)c1OC)N(C)C)=O

InChI

InChI=1S/C16H26N2O2/c1-12(2)10-16(19)17-11-14(18(3)4)13-8-6-7-9-15(13)20-5/h6-9,12,14H,10-11H2,1-5H3,(H,17,19)/t14-/m0/s1

InChI Key

HXJYRKUMKTXSTL-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD12918800

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

278.39

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.334

Distribution Coefficient, logD

1.767

Water Solubility, LogSw

-2.77

Polar Surface Area

34.682

Acid Dissociation Constant (pKa)

12.87

Base Dissociation Constant (pKb)

7.83

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

56.30

D232-0618 in Drug Discovery

Included in Screening Libraries

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

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Cardiovascular Library (22201 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with D232-0618 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D232-0618?
Check Price and Availability of D232-0618, 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 D232-0618 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D232-0618
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D232-0618
  • 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 D232-0618 available by request