3379-0499 Screening compound: 2-(dimethylamino)ethyl 1-phenylcyclopentane-1-carboxylate

3379-0499 Screening compound: 2-(dimethylamino)ethyl 1-phenylcyclopentane-1-carboxylate
3379-0499 Screening compound: 2-(dimethylamino)ethyl 1-phenylcyclopentane-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3379-0499
2-(dimethylamino)ethyl 1-phenylcyclopentane-1-carboxylate

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

3379-0499

Molecular Formula

C16H23NO2 (C16 H23 NO2)

Compound Name

2-(dimethylamino)ethyl 1-phenylcyclopentane-1-carboxylate

IUPAC name

2-(dimethylamino)ethyl 1-phenylcyclopentane-1-carboxylate

SMILES

CN(C)CCOC(C1(CCCC1)c1ccccc1)=O

InChI

InChI=1S/C16H23NO2/c1-17(2)12-13-19-15(18)16(10-6-7-11-16)14-8-4-3-5-9-14/h3-5,8-9H,6-7,10-13H2,1-2H3

InChI Key

VZAZOXVEMAUMLH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01735375

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

261.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.796

Distribution Coefficient, logD

1.172

Water Solubility, LogSw

-2.91

Polar Surface Area

25.438

Acid Dissociation Constant (pKa)

24.75

Base Dissociation Constant (pKb)

9.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.30

3379-0499 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Library (67538 compounds)

CNS BBB Library (22607 compounds)

Cardiovascular Library (22201 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Soluble Diversity Library (15920 compounds)

New Agro Library (44492 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Cardiovascular
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3379-0499 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3379-0499?
Check Price and Availability of 3379-0499, 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 3379-0499 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3379-0499
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3379-0499
  • 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 3379-0499 available by request