L759-0858 Screening compound: ethyl 1-{4-[3-(2,3-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]quinolin-2-yl}piperidine-4-carboxylate

L759-0858 Screening compound: ethyl 1-{4-[3-(2,3-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]quinolin-2-yl}piperidine-4-carboxylate
L759-0858 Screening compound: ethyl 1-{4-[3-(2,3-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]quinolin-2-yl}piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound L759-0858
ethyl 1-{4-[3-(2,3-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]quinolin-2-yl}piperidine-4-carboxylate

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

L759-0858

Molecular Formula

C27H28N4O5 (C27 H28 N4 O5)

Compound Name

ethyl 1-{4-[3-(2,3-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]quinolin-2-yl}piperidine-4-carboxylate

IUPAC name

ethyl 1-{4-[3-(23-dimethoxyphenyl)-124-oxadiazol-5-yl]quinolin-2-yl}piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1c1nc2ccccc2c(-c2nc(-c(cccc3OC)c3OC)no2)c1)=O

InChI

InChI=1S/C27H28N4O5/c1-4-35-27(32)17-12-14-31(15-13-17)23-16-20(18-8-5-6-10-21(18)28-23)26-29-25(30-36-26)19-9-7-11-22(33-2)24(19)34-3/h5-11,16-17H,4,12-15H2,1-3H3

InChI Key

TXVLEICTUCLUKF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27473895

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

488.54

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.622

Distribution Coefficient, logD

5.622

Water Solubility, LogSw

-5.76

Polar Surface Area

78.992

Acid Dissociation Constant (pKa)

22.62

Base Dissociation Constant (pKb)

3.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

L759-0858 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 L759-0858 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L759-0858?
Check Price and Availability of L759-0858, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of L759-0858 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L759-0858
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L759-0858
  • 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 L759-0858 available by request