D237-0095 Screening compound: 4-[3-(3-ethoxy-4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(piperidin-1-yl)butan-1-one

D237-0095 Screening compound: 4-[3-(3-ethoxy-4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(piperidin-1-yl)butan-1-one
D237-0095 Screening compound: 4-[3-(3-ethoxy-4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(piperidin-1-yl)butan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D237-0095
4-[3-(3-ethoxy-4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(piperidin-1-yl)butan-1-one

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

D237-0095

Molecular Formula

C20H27N3O4 (C20 H27 N3 O4)

Compound Name

4-[3-(3-ethoxy-4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(piperidin-1-yl)butan-1-one

IUPAC name

4-[3-(3-ethoxy-4-methoxyphenyl)-124-oxadiazol-5-yl]-1-(piperidin-1-yl)butan-1-one

SMILES

CCOc(cc(cc1)-c2noc(CCCC(N3CCCCC3)=O)n2)c1OC

InChI

InChI=1S/C20H27N3O4/c1-3-26-17-14-15(10-11-16(17)25-2)20-21-18(27-22-20)8-7-9-19(24)23-12-5-4-6-13-23/h10-11,14H,3-9,12-13H2,1-2H3

InChI Key

IKHIPEJLZJRSRS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07188519

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.45

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

2.995

Distribution Coefficient, logD

2.995

Water Solubility, LogSw

-3.16

Polar Surface Area

62.543

Acid Dissociation Constant (pKa)

23.66

Base Dissociation Constant (pKb)

0.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

55.00

References: we are preparing a list of scientific research reports with D237-0095 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D237-0095?
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What is the minimum amount of D237-0095 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D237-0095
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D237-0095
  • 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 D237-0095 available by request