F018-1565 Screening compound: N-(4-cyanophenyl)-2-[3-(trifluoromethyl)-1H,4H,5H,6H-cyclopenta[c]pyrazol-1-yl]acetamide

F018-1565 Screening compound: N-(4-cyanophenyl)-2-[3-(trifluoromethyl)-1H,4H,5H,6H-cyclopenta[c]pyrazol-1-yl]acetamide
F018-1565 Screening compound: N-(4-cyanophenyl)-2-[3-(trifluoromethyl)-1H,4H,5H,6H-cyclopenta[c]pyrazol-1-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F018-1565
N-(4-cyanophenyl)-2-[3-(trifluoromethyl)-1H,4H,5H,6H-cyclopenta[c]pyrazol-1-yl]acetamide

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

F018-1565

Molecular Formula

C16H13F3N4O (C16 H13 F3 N4 O)

Compound Name

N-(4-cyanophenyl)-2-[3-(trifluoromethyl)-1H,4H,5H,6H-cyclopenta[c]pyrazol-1-yl]acetamide

IUPAC name

N-(4-cyanophenyl)-2-[3-(trifluoromethyl)-1H4H5H6H-cyclopenta[c]pyrazol-1-yl]acetamide

SMILES

N#Cc(cc1)ccc1NC(Cn1nc(C(F)(F)F)c2c1CCC2)=O

InChI

InChI=1S/C16H13F3N4O/c17-16(18,19)15-12-2-1-3-13(12)23(22-15)9-14(24)21-11-6-4-10(8-20)5-7-11/h4-7H,1-3,9H2,(H,21,24)

InChI Key

JOZMHWLTNWKEBD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02732444

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.539

Distribution Coefficient, logD

2.538

Water Solubility, LogSw

-3.00

Polar Surface Area

55.191

Acid Dissociation Constant (pKa)

10.26

Base Dissociation Constant (pKb)

-2.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

F018-1565 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 F018-1565 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F018-1565?
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What is the minimum amount of F018-1565 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F018-1565
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F018-1565
  • 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 F018-1565 available by request