L269-0045 Screening compound: 1-[4-(1,2-BENZISOXAZOL-3-YLMETHYL)PIPERAZINO]-2-CYCLOPENTYL-1-ETHANONE

L269-0045 Screening compound: 1-[4-(1,2-BENZISOXAZOL-3-YLMETHYL)PIPERAZINO]-2-CYCLOPENTYL-1-ETHANONE
L269-0045 Screening compound: 1-[4-(1,2-BENZISOXAZOL-3-YLMETHYL)PIPERAZINO]-2-CYCLOPENTYL-1-ETHANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound L269-0045
1-[4-(1,2-BENZISOXAZOL-3-YLMETHYL)PIPERAZINO]-2-CYCLOPENTYL-1-ETHANONE

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

L269-0045

Molecular Formula

C19H25N3O2 (C19 H25 N3 O2)

Compound Name

1-[4-(1,2-BENZISOXAZOL-3-YLMETHYL)PIPERAZINO]-2-CYCLOPENTYL-1-ETHANONE

IUPAC name

n/a

SMILES

O=C(CC1CCCC1)N1CCN(Cc2noc3c2cccc3)CC1

InChI

InChI=1S/C19H25N3O2/c23-19(13-15-5-1-2-6-15)22-11-9-21(10-12-22)14-17-16-7-3-4-8-18(16)24-20-17/h3-4,7-8,15H,1-2,5-6,9-14H2

InChI Key

NXRGNDWDQNGKGE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15122227

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

327.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.851

Distribution Coefficient, logD

2.848

Water Solubility, LogSw

-3.05

Polar Surface Area

43.152

Acid Dissociation Constant (pKa)

24.23

Base Dissociation Constant (pKb)

5.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.90

L269-0045 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

GPCR Targeted Library (31838 compounds)

Anti-HIV1 Library (19540 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with L269-0045 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L269-0045?
Check Price and Availability of L269-0045, 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 L269-0045 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L269-0045
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L269-0045
  • 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 L269-0045 available by request