E613-0805 Screening compound: ethyl 1-(2-{[5-(thiophen-2-yl)-1,2-oxazol-3-yl]methoxy}acetyl)piperidine-4-carboxylate

E613-0805 Screening compound: ethyl 1-(2-{[5-(thiophen-2-yl)-1,2-oxazol-3-yl]methoxy}acetyl)piperidine-4-carboxylate
E613-0805 Screening compound: ethyl 1-(2-{[5-(thiophen-2-yl)-1,2-oxazol-3-yl]methoxy}acetyl)piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound E613-0805
ethyl 1-(2-{[5-(thiophen-2-yl)-1,2-oxazol-3-yl]methoxy}acetyl)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

E613-0805

Molecular Formula

C18H22N2O5S (C18 H22 N2 O5 S)

Compound Name

ethyl 1-(2-{[5-(thiophen-2-yl)-1,2-oxazol-3-yl]methoxy}acetyl)piperidine-4-carboxylate

IUPAC name

ethyl 1-(2-{[5-(thiophen-2-yl)-12-oxazol-3-yl]methoxy}acetyl)piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1C(COCc1noc(-c2cccs2)c1)=O)=O

InChI

InChI=1S/C18H22N2O5S/c1-2-24-18(22)13-5-7-20(8-6-13)17(21)12-23-11-14-10-15(25-19-14)16-4-3-9-26-16/h3-4,9-10,13H,2,5-8,11-12H2,1H3

InChI Key

XEVKOXFEMIYURQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14904186

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.45

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.215

Distribution Coefficient, logD

2.215

Water Solubility, LogSw

-2.54

Polar Surface Area

68.596

Acid Dissociation Constant (pKa)

21.21

Base Dissociation Constant (pKb)

-0.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

E613-0805 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with E613-0805 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E613-0805?
Check Price and Availability of E613-0805, 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 E613-0805 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E613-0805
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E613-0805
  • 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 E613-0805 available by request