SC04-0627 Screening compound: 1-{3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethoxy]piperidino}-2-(4-methoxyphenyl)-1-ethanone

SC04-0627 Screening compound: 1-{3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethoxy]piperidino}-2-(4-methoxyphenyl)-1-ethanone
SC04-0627 Screening compound: 1-{3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethoxy]piperidino}-2-(4-methoxyphenyl)-1-ethanone alternative view

Chemical Structure Depiction of ChemDiv screening compound SC04-0627
1-{3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethoxy]piperidino}-2-(4-methoxyphenyl)-1-ethanone

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

SC04-0627

Molecular Formula

C21H27N3O4 (C21 H27 N3 O4)

Compound Name

1-{3-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)ethoxy]piperidino}-2-(4-methoxyphenyl)-1-ethanone

IUPAC name

1-{3-[2-(5-cyclopropyl-124-oxadiazol-3-yl)ethoxy]piperidin-1-yl}-2-(4-methoxyphenyl)ethan-1-one

SMILES

COc1ccc(CC(N(CCC2)CC2OCCc2noc(C3CC3)n2)=O)cc1

InChI

InChI=1S/C21H27N3O4/c1-26-17-8-4-15(5-9-17)13-20(25)24-11-2-3-18(14-24)27-12-10-19-22-21(28-23-19)16-6-7-16/h4-5,8-9,16,18H,2-3,6-7,10-14H2,1H3/t18-/m0/s1

InChI Key

ZMFMBQUGEGVVOC-SFHVURJKSA-N

MDL Number (MFCD)

MFCD32252842

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.879

Distribution Coefficient, logD

2.879

Water Solubility, LogSw

-3.08

Polar Surface Area

63.688

Acid Dissociation Constant (pKa)

18.21

Base Dissociation Constant (pKb)

-0.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.14

SC04-0627 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SC04-0627 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC04-0627?
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What is the minimum amount of SC04-0627 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC04-0627
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC04-0627
  • 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 SC04-0627 available by request