S063-0327 Screening compound: N-[1-(oxolane-2-carbonyl)piperidin-4-yl]-3-propoxypyrazin-2-amine

S063-0327 Screening compound: N-[1-(oxolane-2-carbonyl)piperidin-4-yl]-3-propoxypyrazin-2-amine
S063-0327 Screening compound: N-[1-(oxolane-2-carbonyl)piperidin-4-yl]-3-propoxypyrazin-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound S063-0327
N-[1-(oxolane-2-carbonyl)piperidin-4-yl]-3-propoxypyrazin-2-amine

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

S063-0327

Molecular Formula

C17H26N4O3 (C17 H26 N4 O3)

Compound Name

N-[1-(oxolane-2-carbonyl)piperidin-4-yl]-3-propoxypyrazin-2-amine

IUPAC name

N-[1-(oxolane-2-carbonyl)piperidin-4-yl]-3-propoxypyrazin-2-amine

SMILES

CCCOc1nccnc1NC(CC1)CCN1C(C1OCCC1)=O

InChI

InChI=1S/C17H26N4O3/c1-2-11-24-16-15(18-7-8-19-16)20-13-5-9-21(10-6-13)17(22)14-4-3-12-23-14/h7-8,13-14H,2-6,9-12H2,1H3,(H,18,20)/t14-/m0/s1

InChI Key

JNCFXIYPTWNGKT-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD29030957

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.746

Distribution Coefficient, logD

1.746

Water Solubility, LogSw

-2.10

Polar Surface Area

61.977

Acid Dissociation Constant (pKa)

19.35

Base Dissociation Constant (pKb)

7.19

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

70.60

S063-0327 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S063-0327 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S063-0327?
Check Price and Availability of S063-0327, 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 S063-0327 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S063-0327
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S063-0327
  • 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 S063-0327 available by request