G771-0455 Screening compound: N-[3-(3-bromophenyl)-1-phenyl-1H-pyrazol-5-yl]-2-methylbenzamide

G771-0455 Screening compound: N-[3-(3-bromophenyl)-1-phenyl-1H-pyrazol-5-yl]-2-methylbenzamide
G771-0455 Screening compound: N-[3-(3-bromophenyl)-1-phenyl-1H-pyrazol-5-yl]-2-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G771-0455
N-[3-(3-bromophenyl)-1-phenyl-1H-pyrazol-5-yl]-2-methylbenzamide

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

G771-0455

Molecular Formula

C23H18BrN3O (C23 H18 BrN3 O)

Compound Name

N-[3-(3-bromophenyl)-1-phenyl-1H-pyrazol-5-yl]-2-methylbenzamide

IUPAC name

N-[3-(3-bromophenyl)-1-phenyl-1H-pyrazol-5-yl]-2-methylbenzamide

SMILES

Cc(cccc1)c1C(Nc1cc(-c2cccc(Br)c2)nn1-c1ccccc1)=O

InChI

InChI=1S/C23H18BrN3O/c1-16-8-5-6-13-20(16)23(28)25-22-15-21(17-9-7-10-18(24)14-17)26-27(22)19-11-3-2-4-12-19/h2-15H,1H3,(H,25,28)

InChI Key

CQEXRBGEPIYQDJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15035017

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.32

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.166

Distribution Coefficient, logD

6.166

Water Solubility, LogSw

-5.55

Polar Surface Area

37.493

Acid Dissociation Constant (pKa)

11.46

Base Dissociation Constant (pKb)

-3.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

G771-0455 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G771-0455 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G771-0455?
Check Price and Availability of G771-0455, 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 G771-0455 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G771-0455
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G771-0455
  • 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 G771-0455 available by request