L826-0151 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-{3-[4-(pyrrolidin-1-yl)phenyl]-1,2,4-oxadiazol-5-yl}propanamide

L826-0151 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-{3-[4-(pyrrolidin-1-yl)phenyl]-1,2,4-oxadiazol-5-yl}propanamide
L826-0151 Screening compound: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-{3-[4-(pyrrolidin-1-yl)phenyl]-1,2,4-oxadiazol-5-yl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L826-0151
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-{3-[4-(pyrrolidin-1-yl)phenyl]-1,2,4-oxadiazol-5-yl}propanamide

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

L826-0151

Molecular Formula

C23H24N4O4 (C23 H24 N4 O4)

Compound Name

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-{3-[4-(pyrrolidin-1-yl)phenyl]-1,2,4-oxadiazol-5-yl}propanamide

IUPAC name

N-(23-dihydro-14-benzodioxin-6-yl)-3-{3-[4-(pyrrolidin-1-yl)phenyl]-124-oxadiazol-5-yl}propanamide

SMILES

O=C(CCc1nc(-c(cc2)ccc2N2CCCC2)no1)Nc(cc1)cc2c1OCCO2

InChI

InChI=1S/C23H24N4O4/c28-21(24-17-5-8-19-20(15-17)30-14-13-29-19)9-10-22-25-23(26-31-22)16-3-6-18(7-4-16)27-11-1-2-12-27/h3-8,15H,1-2,9-14H2,(H,24,28)

InChI Key

FPYQTCSGCUTFEW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27477986

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.433

Distribution Coefficient, logD

3.433

Water Solubility, LogSw

-3.69

Polar Surface Area

74.101

Acid Dissociation Constant (pKa)

11.21

Base Dissociation Constant (pKb)

1.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

L826-0151 in Drug Discovery

Included in Screening Libraries

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

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L826-0151 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L826-0151?
Check Price and Availability of L826-0151, 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 L826-0151 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L826-0151
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L826-0151
  • 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 L826-0151 available by request