T619-4080 Screening compound: 1-{2-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-(thiophen-3-yl)ethan-1-one

T619-4080 Screening compound: 1-{2-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-(thiophen-3-yl)ethan-1-one
T619-4080 Screening compound: 1-{2-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-(thiophen-3-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound T619-4080
1-{2-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-(thiophen-3-yl)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

T619-4080

Molecular Formula

C15H19N3O3S (C15 H19 N3 O3 S)

Compound Name

1-{2-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-(thiophen-3-yl)ethan-1-one

IUPAC name

1-{2-[3-(methoxymethyl)-124-oxadiazol-5-yl]piperidin-1-yl}-2-(thiophen-3-yl)ethan-1-one

SMILES

COCc1noc(C(CCCC2)N2C(Cc2cscc2)=O)n1

InChI

InChI=1S/C15H19N3O3S/c1-20-9-13-16-15(21-17-13)12-4-2-3-6-18(12)14(19)8-11-5-7-22-10-11/h5,7,10,12H,2-4,6,8-9H2,1H3/t12-/m0/s1

InChI Key

MFPUGCGXQHDHHR-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD22387523

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

321.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.042

Distribution Coefficient, logD

2.042

Water Solubility, LogSw

-2.34

Polar Surface Area

58.163

Acid Dissociation Constant (pKa)

19.07

Base Dissociation Constant (pKb)

-2.26

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

53.30

T619-4080 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with T619-4080 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T619-4080?
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What is the minimum amount of T619-4080 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T619-4080
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T619-4080
  • 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 T619-4080 available by request