0386-0446 Screening compound: (3-phenylprop-2-yn-1-yl)dipropylamine

0386-0446 Screening compound: (3-phenylprop-2-yn-1-yl)dipropylamine
0386-0446 Screening compound: (3-phenylprop-2-yn-1-yl)dipropylamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 0386-0446
(3-phenylprop-2-yn-1-yl)dipropylamine

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

0386-0446

Molecular Formula

C15H21N (C15 H21 N)

Compound Name

(3-phenylprop-2-yn-1-yl)dipropylamine

IUPAC name

(3-phenylprop-2-yn-1-yl)dipropylamine

SMILES

CCCN(CCC)CC#Cc1ccccc1

InChI

InChI=1S/C15H21N/c1-3-12-16(13-4-2)14-8-11-15-9-6-5-7-10-15/h5-7,9-10H,3-4,12-14H2,1-2H3

InChI Key

JVLCIWLFCKTNNM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00573581

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

215.34

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

1

Partition Coefficient, logP

4.076

Distribution Coefficient, logD

4.026

Water Solubility, LogSw

-3.95

Polar Surface Area

4.157

Acid Dissociation Constant (pKa)

27.69

Base Dissociation Constant (pKb)

6.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.70

0386-0446 in Drug Discovery

Included in Screening Libraries

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 0386-0446 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0386-0446?
Check Price and Availability of 0386-0446, 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 0386-0446 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0386-0446
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0386-0446
  • 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 0386-0446 available by request