C561-1465 Screening compound: 3-[2-(2,4-dimethoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide

C561-1465 Screening compound: 3-[2-(2,4-dimethoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
C561-1465 Screening compound: 3-[2-(2,4-dimethoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C561-1465
3-[2-(2,4-dimethoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]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

C561-1465

Molecular Formula

C29H34N4O5 (C29 H34 N4 O5)

Compound Name

3-[2-(2,4-dimethoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide

IUPAC name

3-[2-(24-dimethoxyphenyl)-57-dimethylpyrazolo[15-a]pyrimidin-6-yl]-N-[2-(34-dimethoxyphenyl)ethyl]propanamide

SMILES

Cc1c(CCC(NCCc(cc2)cc(OC)c2OC)=O)c(C)nc2cc(-c(ccc(OC)c3)c3OC)nn12

InChI

InChI=1S/C29H34N4O5/c1-18-22(10-12-29(34)30-14-13-20-7-11-25(36-4)27(15-20)38-6)19(2)33-28(31-18)17-24(32-33)23-9-8-21(35-3)16-26(23)37-5/h7-9,11,15-17H,10,12-14H2,1-6H3,(H,30,34)

InChI Key

TTYKDPPGXVFBEM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14770945

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

518.61

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.136

Distribution Coefficient, logD

3.126

Water Solubility, LogSw

-3.41

Polar Surface Area

74.197

Acid Dissociation Constant (pKa)

14.24

Base Dissociation Constant (pKb)

5.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.50

C561-1465 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with C561-1465 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C561-1465?
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What is the minimum amount of C561-1465 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C561-1465
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C561-1465
  • 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 C561-1465 available by request