M882-1104 Screening compound: 2-{[5-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridyl]sulfanyl}-N~1~-(4-pyridylmethyl)acetamide

M882-1104 Screening compound: 2-{[5-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridyl]sulfanyl}-N~1~-(4-pyridylmethyl)acetamide
M882-1104 Screening compound: 2-{[5-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridyl]sulfanyl}-N~1~-(4-pyridylmethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M882-1104
2-{[5-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridyl]sulfanyl}-N~1~-(4-pyridylmethyl)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

M882-1104

Molecular Formula

C16H15N5O2S (C16 H15 N5 O2 S)

Compound Name

2-{[5-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridyl]sulfanyl}-N~1~-(4-pyridylmethyl)acetamide

IUPAC name

2-{[5-(3-methyl-124-oxadiazol-5-yl)pyridin-2-yl]sulfanyl}-N-[(pyridin-4-yl)methyl]acetamide

SMILES

Cc1noc(-c(cc2)cnc2SCC(NCc2ccncc2)=O)n1

InChI

InChI=1S/C16H15N5O2S/c1-11-20-16(23-21-11)13-2-3-15(19-9-13)24-10-14(22)18-8-12-4-6-17-7-5-12/h2-7,9H,8,10H2,1H3,(H,18,22)

InChI Key

LHXWCZJDGMXMAM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27556445

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.39

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.016

Distribution Coefficient, logD

1.012

Water Solubility, LogSw

-1.81

Polar Surface Area

73.655

Acid Dissociation Constant (pKa)

13.67

Base Dissociation Constant (pKb)

5.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.75

M882-1104 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with M882-1104 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M882-1104?
Check Price and Availability of M882-1104, 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 M882-1104 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M882-1104
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M882-1104
  • 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 M882-1104 available by request