C561-0534 Screening compound: 3-[2-(3,5-dimethoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-(4-ethoxyphenyl)propanamide

C561-0534 Screening compound: 3-[2-(3,5-dimethoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-(4-ethoxyphenyl)propanamide
C561-0534 Screening compound: 3-[2-(3,5-dimethoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-(4-ethoxyphenyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C561-0534
3-[2-(3,5-dimethoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-(4-ethoxyphenyl)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

C561-0534

Molecular Formula

C27H30N4O4 (C27 H30 N4 O4)

Compound Name

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

IUPAC name

3-[2-(35-dimethoxyphenyl)-57-dimethylpyrazolo[15-a]pyrimidin-6-yl]-N-(4-ethoxyphenyl)propanamide

SMILES

CCOc(cc1)ccc1NC(CCc(c(C)nc1c2)c(C)n1nc2-c1cc(OC)cc(OC)c1)=O

InChI

InChI=1S/C27H30N4O4/c1-6-35-21-9-7-20(8-10-21)29-27(32)12-11-24-17(2)28-26-16-25(30-31(26)18(24)3)19-13-22(33-4)15-23(14-19)34-5/h7-10,13-16H,6,11-12H2,1-5H3,(H,29,32)

InChI Key

VSBJMQGXAKUKFN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14770206

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.702

Distribution Coefficient, logD

4.672

Water Solubility, LogSw

-4.37

Polar Surface Area

64.810

Acid Dissociation Constant (pKa)

12.06

Base Dissociation Constant (pKb)

6.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.60

References: we are preparing a list of scientific research reports with C561-0534 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C561-0534?
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What is the minimum amount of C561-0534 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C561-0534
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C561-0534
  • 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 C561-0534 available by request