F465-0395 Screening compound: 1-(4-benzylpiperidin-1-yl)-2-{[5-(4-fluorophenyl)-1,3-oxazol-2-yl]sulfanyl}ethan-1-one

F465-0395 Screening compound: 1-(4-benzylpiperidin-1-yl)-2-{[5-(4-fluorophenyl)-1,3-oxazol-2-yl]sulfanyl}ethan-1-one
F465-0395 Screening compound: 1-(4-benzylpiperidin-1-yl)-2-{[5-(4-fluorophenyl)-1,3-oxazol-2-yl]sulfanyl}ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F465-0395
1-(4-benzylpiperidin-1-yl)-2-{[5-(4-fluorophenyl)-1,3-oxazol-2-yl]sulfanyl}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

F465-0395

Molecular Formula

C23H23FN2O2S (C23 H23 FN2 O2 S)

Compound Name

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

IUPAC name

1-(4-benzylpiperidin-1-yl)-2-{[5-(4-fluorophenyl)-13-oxazol-2-yl]sulfanyl}ethan-1-one

SMILES

O=C(CSc1ncc(-c(cc2)ccc2F)o1)N1CCC(Cc2ccccc2)CC1

InChI

InChI=1S/C23H23FN2O2S/c24-20-8-6-19(7-9-20)21-15-25-23(28-21)29-16-22(27)26-12-10-18(11-13-26)14-17-4-2-1-3-5-17/h1-9,15,18H,10-14,16H2

InChI Key

JDQUUZUHWGDTRS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27131365

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.51

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.241

Distribution Coefficient, logD

5.241

Water Solubility, LogSw

-5.37

Polar Surface Area

33.393

Acid Dissociation Constant (pKa)

20.62

Base Dissociation Constant (pKb)

1.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

F465-0395 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 F465-0395 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F465-0395?
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What is the minimum amount of F465-0395 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F465-0395
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F465-0395
  • 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 F465-0395 available by request