G771-0699 Screening compound: N-[3-(2-fluorophenyl)-1-phenyl-1H-pyrazol-5-yl]-2,2-dimethylpropanamide

G771-0699 Screening compound: N-[3-(2-fluorophenyl)-1-phenyl-1H-pyrazol-5-yl]-2,2-dimethylpropanamide
G771-0699 Screening compound: N-[3-(2-fluorophenyl)-1-phenyl-1H-pyrazol-5-yl]-2,2-dimethylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G771-0699
N-[3-(2-fluorophenyl)-1-phenyl-1H-pyrazol-5-yl]-2,2-dimethylpropanamide

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

G771-0699

Molecular Formula

C20H20FN3O (C20 H20 FN3 O)

Compound Name

N-[3-(2-fluorophenyl)-1-phenyl-1H-pyrazol-5-yl]-2,2-dimethylpropanamide

IUPAC name

N-[3-(2-fluorophenyl)-1-phenyl-1H-pyrazol-5-yl]-22-dimethylpropanamide

SMILES

CC(C)(C)C(Nc1cc(-c(cccc2)c2F)nn1-c1ccccc1)=O

InChI

InChI=1S/C20H20FN3O/c1-20(2,3)19(25)22-18-13-17(15-11-7-8-12-16(15)21)23-24(18)14-9-5-4-6-10-14/h4-13H,1-3H3,(H,22,25)

InChI Key

JCWNOHSDOFQYAC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27157562

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.4

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

4.562

Distribution Coefficient, logD

4.562

Water Solubility, LogSw

-4.41

Polar Surface Area

37.765

Acid Dissociation Constant (pKa)

12.06

Base Dissociation Constant (pKb)

-3.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

G771-0699 in Drug Discovery

Included in Screening Libraries

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

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G771-0699 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G771-0699?
Check Price and Availability of G771-0699, 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 G771-0699 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G771-0699
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G771-0699
  • 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 G771-0699 available by request