E598-0017 Screening compound: N-(3,4-dimethoxyphenyl)-1-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-3-piperidinecarboxamide

E598-0017 Screening compound: N-(3,4-dimethoxyphenyl)-1-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-3-piperidinecarboxamide
E598-0017 Screening compound: N-(3,4-dimethoxyphenyl)-1-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-3-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E598-0017
N-(3,4-dimethoxyphenyl)-1-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-3-piperidinecarboxamide

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

E598-0017

Molecular Formula

C23H26N4O5 (C23 H26 N4 O5)

Compound Name

N-(3,4-dimethoxyphenyl)-1-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-3-piperidinecarboxamide

IUPAC name

N-(34-dimethoxyphenyl)-1-[3-(4-methoxyphenyl)-124-oxadiazol-5-yl]piperidine-3-carboxamide

SMILES

COc(cc1)ccc1-c1noc(N(CCC2)CC2C(Nc(cc2)cc(OC)c2OC)=O)n1

InChI

InChI=1S/C23H26N4O5/c1-29-18-9-6-15(7-10-18)21-25-23(32-26-21)27-12-4-5-16(14-27)22(28)24-17-8-11-19(30-2)20(13-17)31-3/h6-11,13,16H,4-5,12,14H2,1-3H3,(H,24,28)/t16-/m0/s1

InChI Key

ZEOMLBSSUHCLMQ-INIZCTEOSA-N

MDL Number (MFCD)

MFCD14902406

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.48

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.317

Distribution Coefficient, logD

3.317

Water Solubility, LogSw

-3.54

Polar Surface Area

81.269

Acid Dissociation Constant (pKa)

10.70

Base Dissociation Constant (pKb)

2.07

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.78

E598-0017 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with E598-0017 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E598-0017?
Check Price and Availability of E598-0017, 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 E598-0017 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E598-0017
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E598-0017
  • 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 E598-0017 available by request