G904-0407 Screening compound: N-cycloheptyl-4-(3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzamide

G904-0407 Screening compound: N-cycloheptyl-4-(3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzamide
G904-0407 Screening compound: N-cycloheptyl-4-(3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G904-0407
N-cycloheptyl-4-(3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzamide

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

G904-0407

Molecular Formula

C24H31N3O2 (C24 H31 N3 O2)

Compound Name

N-cycloheptyl-4-(3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzamide

IUPAC name

N-cycloheptyl-4-(366-trimethyl-4-oxo-4567-tetrahydro-1H-indazol-1-yl)benzamide

SMILES

CC(C)(Cc1c2c(C)nn1-c(cc1)ccc1C(NC1CCCCCC1)=O)CC2=O

InChI

InChI=1S/C24H31N3O2/c1-16-22-20(14-24(2,3)15-21(22)28)27(26-16)19-12-10-17(11-13-19)23(29)25-18-8-6-4-5-7-9-18/h10-13,18H,4-9,14-15H2,1-3H3,(H,25,29)

InChI Key

GABHOSKAZVOGJI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15074742

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.003

Distribution Coefficient, logD

4.003

Water Solubility, LogSw

-4.37

Polar Surface Area

52.279

Acid Dissociation Constant (pKa)

13.31

Base Dissociation Constant (pKb)

-0.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

54.20

G904-0407 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Anti-infective Library (19449 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Cyclic compounds
Therapeutical areas:
  • Infections
  • Immune system
  • animal
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with G904-0407 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G904-0407?
Check Price and Availability of G904-0407, 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 G904-0407 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G904-0407
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G904-0407
  • 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 G904-0407 available by request