C301-3241 Screening compound: 5-[(benzenesulfonyl)methyl]-N-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazole-2-carboxamide

C301-3241 Screening compound: 5-[(benzenesulfonyl)methyl]-N-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazole-2-carboxamide
C301-3241 Screening compound: 5-[(benzenesulfonyl)methyl]-N-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-3241
5-[(benzenesulfonyl)methyl]-N-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazole-2-carboxamide

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

C301-3241

Molecular Formula

C18H17N3O5S (C18 H17 N3 O5 S)

Compound Name

5-[(benzenesulfonyl)methyl]-N-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazole-2-carboxamide

IUPAC name

5-[(benzenesulfonyl)methyl]-N-[(3-methoxyphenyl)methyl]-134-oxadiazole-2-carboxamide

SMILES

COc1cccc(CNC(c2nnc(CS(c3ccccc3)(=O)=O)o2)=O)c1

InChI

InChI=1S/C18H17N3O5S/c1-25-14-7-5-6-13(10-14)11-19-17(22)18-21-20-16(26-18)12-27(23,24)15-8-3-2-4-9-15/h2-10H,11-12H2,1H3,(H,19,22)

InChI Key

LXWWBRZVWMMWFZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14743041

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.42

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.363

Distribution Coefficient, logD

1.363

Water Solubility, LogSw

-2.39

Polar Surface Area

91.413

Acid Dissociation Constant (pKa)

11.94

Base Dissociation Constant (pKb)

-2.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

C301-3241 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C301-3241 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-3241?
Check Price and Availability of C301-3241, 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 C301-3241 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-3241
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-3241
  • 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 C301-3241 available by request