G339-0777 Screening compound: N-butyl-1-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide

G339-0777 Screening compound: N-butyl-1-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide
G339-0777 Screening compound: N-butyl-1-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G339-0777
N-butyl-1-[(3-methoxyphenyl)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

G339-0777

Molecular Formula

C20H23N3O2 (C20 H23 N3 O2)

Compound Name

N-butyl-1-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide

IUPAC name

N-butyl-1-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide

SMILES

CCCCNC(c1cc(n(Cc2cc(OC)ccc2)nc2)c2cc1)=O

InChI

InChI=1S/C20H23N3O2/c1-3-4-10-21-20(24)16-8-9-17-13-22-23(19(17)12-16)14-15-6-5-7-18(11-15)25-2/h5-9,11-13H,3-4,10,14H2,1-2H3,(H,21,24)

InChI Key

ISNSKPREBIPEAA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27135992

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.711

Distribution Coefficient, logD

3.711

Water Solubility, LogSw

-3.89

Polar Surface Area

45.740

Acid Dissociation Constant (pKa)

14.49

Base Dissociation Constant (pKb)

-1.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

G339-0777 in Drug Discovery

Included in Screening Libraries

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

NOTUM (Wnt signaling) Library (3881 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G339-0777 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G339-0777?
Check Price and Availability of G339-0777, 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 G339-0777 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G339-0777
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G339-0777
  • 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 G339-0777 available by request