G771-0905 Screening compound: N-[3-(2-methoxyphenyl)-1-phenyl-1H-pyrazol-5-yl]-2-phenoxybutanamide

G771-0905 Screening compound: N-[3-(2-methoxyphenyl)-1-phenyl-1H-pyrazol-5-yl]-2-phenoxybutanamide
G771-0905 Screening compound: N-[3-(2-methoxyphenyl)-1-phenyl-1H-pyrazol-5-yl]-2-phenoxybutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G771-0905
N-[3-(2-methoxyphenyl)-1-phenyl-1H-pyrazol-5-yl]-2-phenoxybutanamide

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

G771-0905

Molecular Formula

C26H25N3O3 (C26 H25 N3 O3)

Compound Name

N-[3-(2-methoxyphenyl)-1-phenyl-1H-pyrazol-5-yl]-2-phenoxybutanamide

IUPAC name

N-[3-(2-methoxyphenyl)-1-phenyl-1H-pyrazol-5-yl]-2-phenoxybutanamide

SMILES

CCC(C(Nc1cc(-c(cccc2)c2OC)nn1-c1ccccc1)=O)Oc1ccccc1

InChI

InChI=1S/C26H25N3O3/c1-3-23(32-20-14-8-5-9-15-20)26(30)27-25-18-22(21-16-10-11-17-24(21)31-2)28-29(25)19-12-6-4-7-13-19/h4-18,23H,3H2,1-2H3,(H,27,30)/t23-/m0/s1

InChI Key

XRXYLRANMXOHTD-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD15035057

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.506

Distribution Coefficient, logD

5.506

Water Solubility, LogSw

-5.47

Polar Surface Area

51.796

Acid Dissociation Constant (pKa)

13.31

Base Dissociation Constant (pKb)

-3.24

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

15.40

G771-0905 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

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

CNS targets activity set (6557 compounds)

Human GPCR Annotated Library (5539 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with G771-0905 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G771-0905?
Check Price and Availability of G771-0905, 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 G771-0905 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G771-0905
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G771-0905
  • 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 G771-0905 available by request