4872-0792 Screening compound: ethyl 1-{4-nitro-1-phenyl-3-[(Z)-(2-phenylhydrazin-1-ylidene)methyl]-1H-pyrazol-5-yl}piperidine-4-carboxylate

4872-0792 Screening compound: ethyl 1-{4-nitro-1-phenyl-3-[(Z)-(2-phenylhydrazin-1-ylidene)methyl]-1H-pyrazol-5-yl}piperidine-4-carboxylate
4872-0792 Screening compound: ethyl 1-{4-nitro-1-phenyl-3-[(Z)-(2-phenylhydrazin-1-ylidene)methyl]-1H-pyrazol-5-yl}piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4872-0792
ethyl 1-{4-nitro-1-phenyl-3-[(Z)-(2-phenylhydrazin-1-ylidene)methyl]-1H-pyrazol-5-yl}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

4872-0792

Molecular Formula

C24H26N6O4 (C24 H26 N6 O4)

Compound Name

ethyl 1-{4-nitro-1-phenyl-3-[(Z)-(2-phenylhydrazin-1-ylidene)methyl]-1H-pyrazol-5-yl}piperidine-4-carboxylate

IUPAC name

ethyl 1-{4-nitro-1-phenyl-3-[(Z)-(2-phenylhydrazin-1-ylidene)methyl]-1H-pyrazol-5-yl}piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1c(n(-c1ccccc1)nc1/C=N\Nc2ccccc2)c1[N+]([O-])=O)=O

InChI

InChI=1S/C24H26N6O4/c1-2-34-24(31)18-13-15-28(16-14-18)23-22(30(32)33)21(17-25-26-19-9-5-3-6-10-19)27-29(23)20-11-7-4-8-12-20/h3-12,17-18,26H,2,13-16H2,1H3

InChI Key

AMLJWHQFPOKTNR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14710234

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

462.51

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

5.233

Distribution Coefficient, logD

5.233

Water Solubility, LogSw

-5.07

Polar Surface Area

92.274

Acid Dissociation Constant (pKa)

15.08

Base Dissociation Constant (pKb)

3.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

References: we are preparing a list of scientific research reports with 4872-0792 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4872-0792?
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What is the minimum amount of 4872-0792 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4872-0792
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4872-0792
  • 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 4872-0792 available by request