SC03-0486 Screening compound: 2-({4-[2-(5-isobutyl-1,2,4-oxadiazol-3-yl)ethoxy]piperidino}methyl)-4,5-dimethoxyphenyl methyl ether

SC03-0486 Screening compound: 2-({4-[2-(5-isobutyl-1,2,4-oxadiazol-3-yl)ethoxy]piperidino}methyl)-4,5-dimethoxyphenyl methyl ether
SC03-0486 Screening compound: 2-({4-[2-(5-isobutyl-1,2,4-oxadiazol-3-yl)ethoxy]piperidino}methyl)-4,5-dimethoxyphenyl methyl ether alternative view

Chemical Structure Depiction of ChemDiv screening compound SC03-0486
2-({4-[2-(5-isobutyl-1,2,4-oxadiazol-3-yl)ethoxy]piperidino}methyl)-4,5-dimethoxyphenyl methyl ether

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

SC03-0486

Molecular Formula

C23H35N3O5 (C23 H35 N3 O5)

Compound Name

2-({4-[2-(5-isobutyl-1,2,4-oxadiazol-3-yl)ethoxy]piperidino}methyl)-4,5-dimethoxyphenyl methyl ether

IUPAC name

4-{2-[5-(2-methylpropyl)-124-oxadiazol-3-yl]ethoxy}-1-[(245-trimethoxyphenyl)methyl]piperidine

SMILES

CC(C)Cc1nc(CCOC2CCN(Cc(cc(c(OC)c3)OC)c3OC)CC2)no1

InChI

InChI=1S/C23H35N3O5/c1-16(2)12-23-24-22(25-31-23)8-11-30-18-6-9-26(10-7-18)15-17-13-20(28-4)21(29-5)14-19(17)27-3/h13-14,16,18H,6-12,15H2,1-5H3

InChI Key

YQOFPMQOMOTEER-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32251360

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.55

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.259

Distribution Coefficient, logD

0.787

Water Solubility, LogSw

-3.28

Polar Surface Area

66.127

Acid Dissociation Constant (pKa)

25.29

Base Dissociation Constant (pKb)

9.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

65.22

SC03-0486 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SC03-0486 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC03-0486?
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What is the minimum amount of SC03-0486 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC03-0486
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC03-0486
  • 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 SC03-0486 available by request