C660-0787 Screening compound: N-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propyl}-3-(4-chlorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine

C660-0787 Screening compound: N-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propyl}-3-(4-chlorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine
C660-0787 Screening compound: N-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propyl}-3-(4-chlorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound C660-0787
N-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propyl}-3-(4-chlorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine

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

C660-0787

Molecular Formula

C25H26Cl2N6O (C25 H26 Cl2 N6 O)

Compound Name

N-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propyl}-3-(4-chlorophenyl)-[1,2]oxazolo[5,4-d]pyrimidin-4-amine

IUPAC name

N-{3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propyl}-3-(4-chlorophenyl)-[12]oxazolo[54-d]pyrimidin-4-amine

SMILES

Cc(ccc(Cl)c1)c1N1CCN(CCCNc2ncnc3c2c(-c(cc2)ccc2Cl)no3)CC1

InChI

InChI=1S/C25H26Cl2N6O/c1-17-3-6-20(27)15-21(17)33-13-11-32(12-14-33)10-2-9-28-24-22-23(18-4-7-19(26)8-5-18)31-34-25(22)30-16-29-24/h3-8,15-16H,2,9-14H2,1H3,(H,28,29,30)

InChI Key

UQZGECLKBFAAED-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14780317

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.706

Distribution Coefficient, logD

4.983

Water Solubility, LogSw

-6.12

Polar Surface Area

59.807

Acid Dissociation Constant (pKa)

18.99

Base Dissociation Constant (pKb)

8.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

C660-0787 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with C660-0787 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C660-0787?
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What is the minimum amount of C660-0787 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C660-0787
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C660-0787
  • 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 C660-0787 available by request