C561-1405 Screening compound: 3-[2-(2,4-dimethoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-(2-ethylphenyl)propanamide

C561-1405 Screening compound: 3-[2-(2,4-dimethoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-(2-ethylphenyl)propanamide
C561-1405 Screening compound: 3-[2-(2,4-dimethoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-(2-ethylphenyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C561-1405
3-[2-(2,4-dimethoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-N-(2-ethylphenyl)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

C561-1405

Molecular Formula

C27H30N4O3 (C27 H30 N4 O3)

Compound Name

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

IUPAC name

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

SMILES

CCc(cccc1)c1NC(CCc(c(C)nc1c2)c(C)n1nc2-c(ccc(OC)c1)c1OC)=O

InChI

InChI=1S/C27H30N4O3/c1-6-19-9-7-8-10-23(19)29-27(32)14-13-21-17(2)28-26-16-24(30-31(26)18(21)3)22-12-11-20(33-4)15-25(22)34-5/h7-12,15-16H,6,13-14H2,1-5H3,(H,29,32)

InChI Key

BHMPMFDQXJOSCB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14770895

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

458.56

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

4.643

Distribution Coefficient, logD

4.634

Water Solubility, LogSw

-4.42

Polar Surface Area

57.075

Acid Dissociation Constant (pKa)

12.59

Base Dissociation Constant (pKb)

5.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.60

References: we are preparing a list of scientific research reports with C561-1405 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C561-1405?
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What is the minimum amount of C561-1405 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C561-1405
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C561-1405
  • 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 C561-1405 available by request