Y021-1162 Screening compound: 5-amino-1-(3-fluorophenyl)-1H-pyrazole-4-carbonitrile

Y021-1162 Screening compound: 5-amino-1-(3-fluorophenyl)-1H-pyrazole-4-carbonitrile
Y021-1162 Screening compound: 5-amino-1-(3-fluorophenyl)-1H-pyrazole-4-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound Y021-1162
5-amino-1-(3-fluorophenyl)-1H-pyrazole-4-carbonitrile

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

Y021-1162

Molecular Formula

C10H7FN4 (C10 H7 FN4)

Compound Name

5-amino-1-(3-fluorophenyl)-1H-pyrazole-4-carbonitrile

IUPAC name

5-amino-1-(3-fluorophenyl)-1H-pyrazole-4-carbonitrile

SMILES

Nc(n(-c1cccc(F)c1)nc1)c1C#N

InChI

InChI=1S/C10H7FN4/c11-8-2-1-3-9(4-8)15-10(13)7(5-12)6-14-15/h1-4,6H,13H2

InChI Key

QMABEDHYXLYKEL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00128323

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

202.19

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.596

Distribution Coefficient, logD

1.596

Water Solubility, LogSw

-1.79

Polar Surface Area

50.611

Acid Dissociation Constant (pKa)

18.01

Base Dissociation Constant (pKb)

-2.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

Y021-1162 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Fragments Library (11262 compounds)

GABA Library (7115 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Eye
Structure:
  • Fragments
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with Y021-1162 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y021-1162?
Check Price and Availability of Y021-1162, 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 Y021-1162 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y021-1162
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y021-1162
  • 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 Y021-1162 available by request