G339-1064 Screening compound: N-[1-(3,4-dimethylphenyl)ethyl]-1-[(4-fluorophenyl)methyl]-1H-indazole-6-carboxamide

G339-1064 Screening compound: N-[1-(3,4-dimethylphenyl)ethyl]-1-[(4-fluorophenyl)methyl]-1H-indazole-6-carboxamide
G339-1064 Screening compound: N-[1-(3,4-dimethylphenyl)ethyl]-1-[(4-fluorophenyl)methyl]-1H-indazole-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G339-1064
N-[1-(3,4-dimethylphenyl)ethyl]-1-[(4-fluorophenyl)methyl]-1H-indazole-6-carboxamide

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

G339-1064

Molecular Formula

C25H24FN3O (C25 H24 FN3 O)

Compound Name

N-[1-(3,4-dimethylphenyl)ethyl]-1-[(4-fluorophenyl)methyl]-1H-indazole-6-carboxamide

IUPAC name

N-[1-(34-dimethylphenyl)ethyl]-1-[(4-fluorophenyl)methyl]-1H-indazole-6-carboxamide

SMILES

CC(c1cc(C)c(C)cc1)NC(c1cc(n(Cc(cc2)ccc2F)nc2)c2cc1)=O

InChI

InChI=1S/C25H24FN3O/c1-16-4-7-20(12-17(16)2)18(3)28-25(30)21-8-9-22-14-27-29(24(22)13-21)15-19-5-10-23(26)11-6-19/h4-14,18H,15H2,1-3H3,(H,28,30)/t18-/m0/s1

InChI Key

SIBHUEYUZAYHMV-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27136079

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.48

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.366

Distribution Coefficient, logD

5.366

Water Solubility, LogSw

-5.53

Polar Surface Area

37.247

Acid Dissociation Constant (pKa)

12.61

Base Dissociation Constant (pKb)

-2.34

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

G339-1064 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with G339-1064 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G339-1064?
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What is the minimum amount of G339-1064 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G339-1064
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G339-1064
  • 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 G339-1064 available by request