L981-0873 Screening compound: 2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide

L981-0873 Screening compound: 2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
L981-0873 Screening compound: 2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L981-0873
2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide

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

L981-0873

Molecular Formula

C25H28N4O2S (C25 H28 N4 O2 S)

Compound Name

2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide

IUPAC name

2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide

SMILES

COc1cccc(NC(CSc2nccnc2N2CCC(Cc3ccccc3)CC2)=O)c1

InChI

InChI=1S/C25H28N4O2S/c1-31-22-9-5-8-21(17-22)28-23(30)18-32-25-24(26-12-13-27-25)29-14-10-20(11-15-29)16-19-6-3-2-4-7-19/h2-9,12-13,17,20H,10-11,14-16,18H2,1H3,(H,28,30)

InChI Key

GXAPSWSWHNZVGL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15137919

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.59

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.379

Distribution Coefficient, logD

5.379

Water Solubility, LogSw

-5.47

Polar Surface Area

52.001

Acid Dissociation Constant (pKa)

11.74

Base Dissociation Constant (pKb)

6.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

References: we are preparing a list of scientific research reports with L981-0873 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L981-0873?
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What is the minimum amount of L981-0873 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L981-0873
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L981-0873
  • 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 L981-0873 available by request