L947-0133 Screening compound: 4-[5-(1-benzoylpiperidin-3-yl)-1,2,4-oxadiazol-3-yl]-N-[(2-methoxyphenyl)methyl]benzamide

L947-0133 Screening compound: 4-[5-(1-benzoylpiperidin-3-yl)-1,2,4-oxadiazol-3-yl]-N-[(2-methoxyphenyl)methyl]benzamide
L947-0133 Screening compound: 4-[5-(1-benzoylpiperidin-3-yl)-1,2,4-oxadiazol-3-yl]-N-[(2-methoxyphenyl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L947-0133
4-[5-(1-benzoylpiperidin-3-yl)-1,2,4-oxadiazol-3-yl]-N-[(2-methoxyphenyl)methyl]benzamide

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

L947-0133

Molecular Formula

C29H28N4O4 (C29 H28 N4 O4)

Compound Name

4-[5-(1-benzoylpiperidin-3-yl)-1,2,4-oxadiazol-3-yl]-N-[(2-methoxyphenyl)methyl]benzamide

IUPAC name

4-[5-(1-benzoylpiperidin-3-yl)-124-oxadiazol-3-yl]-N-[(2-methoxyphenyl)methyl]benzamide

SMILES

COc1c(CNC(c(cc2)ccc2-c2noc(C(CCC3)CN3C(c3ccccc3)=O)n2)=O)cccc1

InChI

InChI=1S/C29H28N4O4/c1-36-25-12-6-5-10-23(25)18-30-27(34)21-15-13-20(14-16-21)26-31-28(37-32-26)24-11-7-17-33(19-24)29(35)22-8-3-2-4-9-22/h2-6,8-10,12-16,24H,7,11,17-19H2,1H3,(H,30,34)/t24-/m0/s1

InChI Key

DHBMHUPNVAPANV-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD27488973

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.772

Distribution Coefficient, logD

4.772

Water Solubility, LogSw

-4.60

Polar Surface Area

80.270

Acid Dissociation Constant (pKa)

11.78

Base Dissociation Constant (pKb)

-2.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

24.10

L947-0133 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L947-0133 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L947-0133?
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What is the minimum amount of L947-0133 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L947-0133
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L947-0133
  • 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 L947-0133 available by request