C651-0122 Screening compound: 2-ethyl-1-[3-(3-methoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]piperidine

C651-0122 Screening compound: 2-ethyl-1-[3-(3-methoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]piperidine
C651-0122 Screening compound: 2-ethyl-1-[3-(3-methoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound C651-0122
2-ethyl-1-[3-(3-methoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]piperidine

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

C651-0122

Molecular Formula

C18H24N2O3 (C18 H24 N2 O3)

Compound Name

2-ethyl-1-[3-(3-methoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carbonyl]piperidine

IUPAC name

2-ethyl-1-[3-(3-methoxyphenyl)-45-dihydro-12-oxazole-5-carbonyl]piperidine

SMILES

CCC(CCCC1)N1C(C(C1)ON=C1c1cc(OC)ccc1)=O

InChI

InChI=1S/C18H24N2O3/c1-3-14-8-4-5-10-20(14)18(21)17-12-16(19-23-17)13-7-6-9-15(11-13)22-2/h6-7,9,11,14,17H,3-5,8,10,12H2,1-2H3

InChI Key

XEKVFWAZGMKSML-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14779426

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.264

Distribution Coefficient, logD

3.264

Water Solubility, LogSw

-3.23

Polar Surface Area

46.670

Acid Dissociation Constant (pKa)

17.18

Base Dissociation Constant (pKb)

-0.96

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

55.60

References: we are preparing a list of scientific research reports with C651-0122 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C651-0122?
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What is the minimum amount of C651-0122 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C651-0122
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C651-0122
  • 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 C651-0122 available by request