L471-0246 Screening compound: N-[(2-methylphenyl)methyl]-3-[4-(pyrrolidin-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide

L471-0246 Screening compound: N-[(2-methylphenyl)methyl]-3-[4-(pyrrolidin-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
L471-0246 Screening compound: N-[(2-methylphenyl)methyl]-3-[4-(pyrrolidin-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L471-0246
N-[(2-methylphenyl)methyl]-3-[4-(pyrrolidin-1-yl)phenyl]-1,2,4-oxadiazole-5-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

L471-0246

Molecular Formula

C21H22N4O2 (C21 H22 N4 O2)

Compound Name

N-[(2-methylphenyl)methyl]-3-[4-(pyrrolidin-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide

IUPAC name

N-[(2-methylphenyl)methyl]-3-[4-(pyrrolidin-1-yl)phenyl]-124-oxadiazole-5-carboxamide

SMILES

Cc1c(CNC(c2nc(-c(cc3)ccc3N3CCCC3)no2)=O)cccc1

InChI

InChI=1S/C21H22N4O2/c1-15-6-2-3-7-17(15)14-22-20(26)21-23-19(24-27-21)16-8-10-18(11-9-16)25-12-4-5-13-25/h2-3,6-11H,4-5,12-14H2,1H3,(H,22,26)

InChI Key

XCOPSEBNMBCHAB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27255131

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.903

Distribution Coefficient, logD

4.903

Water Solubility, LogSw

-4.52

Polar Surface Area

60.148

Acid Dissociation Constant (pKa)

11.13

Base Dissociation Constant (pKb)

1.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

L471-0246 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with L471-0246 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L471-0246?
Check Price and Availability of L471-0246, 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 L471-0246 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L471-0246
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L471-0246
  • 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 L471-0246 available by request