L981-0878 Screening compound: 2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}-N-(3,5-dimethoxyphenyl)acetamide

L981-0878 Screening compound: 2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}-N-(3,5-dimethoxyphenyl)acetamide
L981-0878 Screening compound: 2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}-N-(3,5-dimethoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L981-0878
2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}-N-(3,5-dimethoxyphenyl)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

L981-0878

Molecular Formula

C26H30N4O3S (C26 H30 N4 O3 S)

Compound Name

2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}-N-(3,5-dimethoxyphenyl)acetamide

IUPAC name

2-{[3-(4-benzylpiperidin-1-yl)pyrazin-2-yl]sulfanyl}-N-(35-dimethoxyphenyl)acetamide

SMILES

COc1cc(NC(CSc2nccnc2N2CCC(Cc3ccccc3)CC2)=O)cc(OC)c1

InChI

InChI=1S/C26H30N4O3S/c1-32-22-15-21(16-23(17-22)33-2)29-24(31)18-34-26-25(27-10-11-28-26)30-12-8-20(9-13-30)14-19-6-4-3-5-7-19/h3-7,10-11,15-17,20H,8-9,12-14,18H2,1-2H3,(H,29,31)

InChI Key

ABGJOSOFDVWWTG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15137923

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.62

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.452

Distribution Coefficient, logD

5.452

Water Solubility, LogSw

-5.49

Polar Surface Area

59.545

Acid Dissociation Constant (pKa)

10.76

Base Dissociation Constant (pKb)

6.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.60

References: we are preparing a list of scientific research reports with L981-0878 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L981-0878?
Check Price and Availability of L981-0878, 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 L981-0878 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L981-0878
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L981-0878
  • 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 L981-0878 available by request