C660-0678 Screening compound: 1-benzyl-4-[3-(4-chlorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]piperazine

C660-0678 Screening compound: 1-benzyl-4-[3-(4-chlorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]piperazine
C660-0678 Screening compound: 1-benzyl-4-[3-(4-chlorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound C660-0678
1-benzyl-4-[3-(4-chlorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]piperazine

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

C660-0678

Molecular Formula

C22H20ClN5O (C22 H20 ClN5 O)

Compound Name

1-benzyl-4-[3-(4-chlorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-yl]piperazine

IUPAC name

1-benzyl-4-[3-(4-chlorophenyl)-[12]oxazolo[54-d]pyrimidin-4-yl]piperazine

SMILES

Clc(cc1)ccc1-c1noc2ncnc(N3CCN(Cc4ccccc4)CC3)c12

InChI

InChI=1S/C22H20ClN5O/c23-18-8-6-17(7-9-18)20-19-21(24-15-25-22(19)29-26-20)28-12-10-27(11-13-28)14-16-4-2-1-3-5-16/h1-9,15H,10-14H2

InChI Key

PXQARVWCNPVBQL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14780222

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.89

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.518

Distribution Coefficient, logD

4.440

Water Solubility, LogSw

-4.93

Polar Surface Area

49.075

Acid Dissociation Constant (pKa)

21.11

Base Dissociation Constant (pKb)

6.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

C660-0678 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
  • Immune system
Mechanism of action:
  • PPI modulators
  • Receptor's ligands
  • Receptor's ligands
Targets:
  • GPCR

References: we are preparing a list of scientific research reports with C660-0678 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C660-0678?
Check Price and Availability of C660-0678, 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 C660-0678 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C660-0678
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C660-0678
  • 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 C660-0678 available by request