E984-0662 Screening compound: N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2-{2-methyl-5-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl}acetamide

E984-0662 Screening compound: N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2-{2-methyl-5-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl}acetamide
E984-0662 Screening compound: N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2-{2-methyl-5-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E984-0662
N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2-{2-methyl-5-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl}acetamide

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

E984-0662

Molecular Formula

C22H29ClN6O2 (C22 H29 ClN6 O2)

Compound Name

N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2-{2-methyl-5-oxo-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-4-yl}acetamide

IUPAC name

N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2-{2-methyl-5-oxo-4H5H6H7H-pyrazolo[15-a]pyrimidin-4-yl}acetamide

SMILES

Cc1nn(CCC(N2CC(NCCCN(CC3)CCN3c3cccc(Cl)c3)=O)=O)c2c1

InChI

InChI=1S/C22H29ClN6O2/c1-17-14-21-28(22(31)6-9-29(21)25-17)16-20(30)24-7-3-8-26-10-12-27(13-11-26)19-5-2-4-18(23)15-19/h2,4-5,14-15H,3,6-13,16H2,1H3,(H,24,30)

InChI Key

IIZQSIMYVLCJNY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14935917

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.96

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.246

Distribution Coefficient, logD

0.660

Water Solubility, LogSw

-2.70

Polar Surface Area

59.654

Acid Dissociation Constant (pKa)

15.56

Base Dissociation Constant (pKb)

7.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

References: we are preparing a list of scientific research reports with E984-0662 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E984-0662?
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What is the minimum amount of E984-0662 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E984-0662
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E984-0662
  • 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 E984-0662 available by request