E613-0720 Screening compound: 1-(4-benzylpiperidin-1-yl)-2-{[5-(thiophen-2-yl)-1,2-oxazol-3-yl]methoxy}ethan-1-one

E613-0720 Screening compound: 1-(4-benzylpiperidin-1-yl)-2-{[5-(thiophen-2-yl)-1,2-oxazol-3-yl]methoxy}ethan-1-one
E613-0720 Screening compound: 1-(4-benzylpiperidin-1-yl)-2-{[5-(thiophen-2-yl)-1,2-oxazol-3-yl]methoxy}ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound E613-0720
1-(4-benzylpiperidin-1-yl)-2-{[5-(thiophen-2-yl)-1,2-oxazol-3-yl]methoxy}ethan-1-one

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

E613-0720

Molecular Formula

C22H24N2O3S (C22 H24 N2 O3 S)

Compound Name

1-(4-benzylpiperidin-1-yl)-2-{[5-(thiophen-2-yl)-1,2-oxazol-3-yl]methoxy}ethan-1-one

IUPAC name

1-(4-benzylpiperidin-1-yl)-2-{[5-(thiophen-2-yl)-12-oxazol-3-yl]methoxy}ethan-1-one

SMILES

O=C(COCc1noc(-c2cccs2)c1)N1CCC(Cc2ccccc2)CC1

InChI

InChI=1S/C22H24N2O3S/c25-22(16-26-15-19-14-20(27-23-19)21-7-4-12-28-21)24-10-8-18(9-11-24)13-17-5-2-1-3-6-17/h1-7,12,14,18H,8-11,13,15-16H2

InChI Key

MZVCMMJDADGBSH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14904157

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.273

Distribution Coefficient, logD

4.273

Water Solubility, LogSw

-4.40

Polar Surface Area

47.571

Acid Dissociation Constant (pKa)

21.21

Base Dissociation Constant (pKb)

-0.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

References: we are preparing a list of scientific research reports with E613-0720 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E613-0720?
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What is the minimum amount of E613-0720 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E613-0720
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E613-0720
  • 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 E613-0720 available by request