S064-0870 Screening compound: 1-(3-propoxy-2-pyrazinyl)-3-pyrrolidinamine

S064-0870 Screening compound: 1-(3-propoxy-2-pyrazinyl)-3-pyrrolidinamine
S064-0870 Screening compound: 1-(3-propoxy-2-pyrazinyl)-3-pyrrolidinamine alternative view

Chemical Structure Depiction of ChemDiv screening compound S064-0870
1-(3-propoxy-2-pyrazinyl)-3-pyrrolidinamine

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

S064-0870

Molecular Formula

C11H18N4O (C11 H18 N4 O)

Compound Name

1-(3-propoxy-2-pyrazinyl)-3-pyrrolidinamine

IUPAC name

1-(3-propoxypyrazin-2-yl)pyrrolidin-3-amine

SMILES

CCCOc1nccnc1N(CC1)CC1N

InChI

InChI=1S/C11H18N4O/c1-2-7-16-11-10(13-4-5-14-11)15-6-3-9(12)8-15/h4-5,9H,2-3,6-8,12H2,1H3/t9-/m1/s1

InChI Key

IWIDASLWNGCLBZ-SECBINFHSA-N

MDL Number (MFCD)

MFCD29022016

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

222.29

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.053

Distribution Coefficient, logD

-0.462

Water Solubility, LogSw

-1.25

Polar Surface Area

49.969

Acid Dissociation Constant (pKa)

23.38

Base Dissociation Constant (pKb)

8.90

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

63.64

S064-0870 in Drug Discovery

Included in Screening Libraries

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

Protein Arginine Methyltransferases Library (27925 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Others
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with S064-0870 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S064-0870?
Check Price and Availability of S064-0870, 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 S064-0870 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S064-0870
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S064-0870
  • 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 S064-0870 available by request