D388-0519 Screening compound: N-[2-(pyrrolidin-1-yl)-2-(thiophen-2-yl)ethyl]propanamide

D388-0519 Screening compound: N-[2-(pyrrolidin-1-yl)-2-(thiophen-2-yl)ethyl]propanamide
D388-0519 Screening compound: N-[2-(pyrrolidin-1-yl)-2-(thiophen-2-yl)ethyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D388-0519
N-[2-(pyrrolidin-1-yl)-2-(thiophen-2-yl)ethyl]propanamide

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

D388-0519

Molecular Formula

C13H20N2OS (C13 H20 N2 OS)

Compound Name

N-[2-(pyrrolidin-1-yl)-2-(thiophen-2-yl)ethyl]propanamide

IUPAC name

N-[2-(pyrrolidin-1-yl)-2-(thiophen-2-yl)ethyl]propanamide

SMILES

CCC(NCC(c1cccs1)N1CCCC1)=O

InChI

InChI=1S/C13H20N2OS/c1-2-13(16)14-10-11(12-6-5-9-17-12)15-7-3-4-8-15/h5-6,9,11H,2-4,7-8,10H2,1H3,(H,14,16)/t11-/m0/s1

InChI Key

QDDAUPJNYYAQDD-NSHDSACASA-N

MDL Number (MFCD)

MFCD12916931

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

252.38

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

1.500

Distribution Coefficient, logD

0.607

Water Solubility, LogSw

-2.35

Polar Surface Area

29.084

Acid Dissociation Constant (pKa)

13.39

Base Dissociation Constant (pKb)

8.23

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

61.50

D388-0519 in Drug Discovery

Included in Screening Libraries

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

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS MPO Library (28609 compounds)

CNS Targets (44014 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Soluble Diversity Library (15920 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
  • Nervous system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with D388-0519 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D388-0519?
Check Price and Availability of D388-0519, 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 D388-0519 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D388-0519
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D388-0519
  • 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 D388-0519 available by request