G904-0401 Screening compound: N-(2-chlorobenzyl)-4-(3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzamide

G904-0401 Screening compound: N-(2-chlorobenzyl)-4-(3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzamide
G904-0401 Screening compound: N-(2-chlorobenzyl)-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 G904-0401
N-(2-chlorobenzyl)-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

G904-0401

Molecular Formula

C24H24ClN3O2 (C24 H24 ClN3 O2)

Compound Name

N-(2-chlorobenzyl)-4-(3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzamide

IUPAC name

N-[(2-chlorophenyl)methyl]-4-(366-trimethyl-4-oxo-4567-tetrahydro-1H-indazol-1-yl)benzamide

SMILES

CC(C)(Cc1c2c(C)nn1-c(cc1)ccc1C(NCc(cccc1)c1Cl)=O)CC2=O

InChI

InChI=1S/C24H24ClN3O2/c1-15-22-20(12-24(2,3)13-21(22)29)28(27-15)18-10-8-16(9-11-18)23(30)26-14-17-6-4-5-7-19(17)25/h4-11H,12-14H2,1-3H3,(H,26,30)

InChI Key

JZGHZVFOIRMXFX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15074739

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.93

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.956

Distribution Coefficient, logD

3.956

Water Solubility, LogSw

-4.60

Polar Surface Area

52.223

Acid Dissociation Constant (pKa)

11.50

Base Dissociation Constant (pKb)

-3.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.17

G904-0401 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G904-0401 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G904-0401?
Check Price and Availability of G904-0401, 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 G904-0401 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G904-0401
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G904-0401
  • 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 G904-0401 available by request