G419-0654 Screening compound: ethyl 1-{2-[2-(4-chlorophenyl)-4-oxo-4H,5H-pyrazolo[1,5-a]pyrazin-5-yl]acetyl}piperidine-4-carboxylate

G419-0654 Screening compound: ethyl 1-{2-[2-(4-chlorophenyl)-4-oxo-4H,5H-pyrazolo[1,5-a]pyrazin-5-yl]acetyl}piperidine-4-carboxylate
G419-0654 Screening compound: ethyl 1-{2-[2-(4-chlorophenyl)-4-oxo-4H,5H-pyrazolo[1,5-a]pyrazin-5-yl]acetyl}piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G419-0654
ethyl 1-{2-[2-(4-chlorophenyl)-4-oxo-4H,5H-pyrazolo[1,5-a]pyrazin-5-yl]acetyl}piperidine-4-carboxylate

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

G419-0654

Molecular Formula

C22H23ClN4O4 (C22 H23 ClN4 O4)

Compound Name

ethyl 1-{2-[2-(4-chlorophenyl)-4-oxo-4H,5H-pyrazolo[1,5-a]pyrazin-5-yl]acetyl}piperidine-4-carboxylate

IUPAC name

ethyl 1-{2-[2-(4-chlorophenyl)-4-oxo-4H5H-pyrazolo[15-a]pyrazin-5-yl]acetyl}piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1C(CN(C=Cn(c1c2)nc2-c(cc2)ccc2Cl)C1=O)=O)=O

InChI

InChI=1S/C22H23ClN4O4/c1-2-31-22(30)16-7-9-25(10-8-16)20(28)14-26-11-12-27-19(21(26)29)13-18(24-27)15-3-5-17(23)6-4-15/h3-6,11-13,16H,2,7-10,14H2,1H3

InChI Key

BDCXMHDOOBXSQM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27140419

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.9

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.997

Distribution Coefficient, logD

1.997

Water Solubility, LogSw

-2.94

Polar Surface Area

65.117

Acid Dissociation Constant (pKa)

23.24

Base Dissociation Constant (pKb)

0.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

References: we are preparing a list of scientific research reports with G419-0654 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G419-0654?
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What is the minimum amount of G419-0654 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G419-0654
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G419-0654
  • 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 G419-0654 available by request