M149-0487 Screening compound: 2-{[5-(1-benzyl-1H-imidazol-4-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide

M149-0487 Screening compound: 2-{[5-(1-benzyl-1H-imidazol-4-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide
M149-0487 Screening compound: 2-{[5-(1-benzyl-1H-imidazol-4-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M149-0487
2-{[5-(1-benzyl-1H-imidazol-4-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-(3-methylphenyl)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

M149-0487

Molecular Formula

C21H19N5O2S (C21 H19 N5 O2 S)

Compound Name

2-{[5-(1-benzyl-1H-imidazol-4-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide

IUPAC name

2-{[5-(1-benzyl-1H-imidazol-4-yl)-134-oxadiazol-2-yl]sulfanyl}-N-(3-methylphenyl)acetamide

SMILES

Cc1cccc(NC(CSc2nnc(-c3cn(Cc4ccccc4)cn3)o2)=O)c1

InChI

InChI=1S/C21H19N5O2S/c1-15-6-5-9-17(10-15)23-19(27)13-29-21-25-24-20(28-21)18-12-26(14-22-18)11-16-7-3-2-4-8-16/h2-10,12,14H,11,13H2,1H3,(H,23,27)

InChI Key

VJEYFFZJUXMWCP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27532662

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.202

Distribution Coefficient, logD

3.202

Water Solubility, LogSw

-3.16

Polar Surface Area

65.277

Acid Dissociation Constant (pKa)

12.98

Base Dissociation Constant (pKb)

4.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

M149-0487 in Drug Discovery

Included in Screening Libraries

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

CORONAVIRUS Library (20774 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with M149-0487 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M149-0487?
Check Price and Availability of M149-0487, 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 M149-0487 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M149-0487
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M149-0487
  • 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 M149-0487 available by request