C561-1115 Screening compound: 3-[2-(2-methoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-[(2-methoxyphenyl)methyl]propanamide

C561-1115 Screening compound: 3-[2-(2-methoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-[(2-methoxyphenyl)methyl]propanamide
C561-1115 Screening compound: 3-[2-(2-methoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-[(2-methoxyphenyl)methyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C561-1115
3-[2-(2-methoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-[(2-methoxyphenyl)methyl]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

C561-1115

Molecular Formula

C26H28N4O3 (C26 H28 N4 O3)

Compound Name

3-[2-(2-methoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-[(2-methoxyphenyl)methyl]propanamide

IUPAC name

3-[2-(2-methoxyphenyl)-57-dimethylpyrazolo[15-a]pyrimidin-6-yl]-N-[(2-methoxyphenyl)methyl]propanamide

SMILES

Cc1c(CCC(NCc(cccc2)c2OC)=O)c(C)nc2cc(-c(cccc3)c3OC)nn12

InChI

InChI=1S/C26H28N4O3/c1-17-20(13-14-26(31)27-16-19-9-5-7-11-23(19)32-3)18(2)30-25(28-17)15-22(29-30)21-10-6-8-12-24(21)33-4/h5-12,15H,13-14,16H2,1-4H3,(H,27,31)

InChI Key

UJSAAXMGRFEOCW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14770661

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.866

Distribution Coefficient, logD

3.856

Water Solubility, LogSw

-4.18

Polar Surface Area

59.182

Acid Dissociation Constant (pKa)

12.87

Base Dissociation Constant (pKb)

5.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

C561-1115 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Dark Chemical Matter Library (18430 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with C561-1115 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C561-1115?
Check Price and Availability of C561-1115, 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 C561-1115 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C561-1115
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C561-1115
  • 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 C561-1115 available by request