G904-0003 Screening compound: ethyl 1-[4-(3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzoyl]-4-piperidinecarboxylate

G904-0003 Screening compound: ethyl 1-[4-(3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzoyl]-4-piperidinecarboxylate
G904-0003 Screening compound: ethyl 1-[4-(3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzoyl]-4-piperidinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G904-0003
ethyl 1-[4-(3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzoyl]-4-piperidinecarboxylate

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

G904-0003

Molecular Formula

C23H27N3O4 (C23 H27 N3 O4)

Compound Name

ethyl 1-[4-(3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzoyl]-4-piperidinecarboxylate

IUPAC name

ethyl 1-[4-(3-methyl-4-oxo-4567-tetrahydro-1H-indazol-1-yl)benzoyl]piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1C(c(cc1)ccc1-n1nc(C)c2c1CCCC2=O)=O)=O

InChI

InChI=1S/C23H27N3O4/c1-3-30-23(29)17-11-13-25(14-12-17)22(28)16-7-9-18(10-8-16)26-19-5-4-6-20(27)21(19)15(2)24-26/h7-10,17H,3-6,11-14H2,1-2H3

InChI Key

RZKTWOFDNJIIAU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15074678

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.063

Distribution Coefficient, logD

2.063

Water Solubility, LogSw

-2.46

Polar Surface Area

65.212

Acid Dissociation Constant (pKa)

19.36

Base Dissociation Constant (pKb)

-1.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.83

G904-0003 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • GPCR
  • Kinases
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
Structure:
  • Cyclic compounds
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G904-0003 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G904-0003?
Check Price and Availability of G904-0003, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of G904-0003 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G904-0003
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G904-0003
  • 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 G904-0003 available by request