P721-1725 Screening compound: N-(2-chloro-4-fluorophenyl)-2-[3-cyclopropyl-5-(pyrrolidine-1-carbonyl)-1H-pyrazol-1-yl]acetamide

P721-1725 Screening compound: N-(2-chloro-4-fluorophenyl)-2-[3-cyclopropyl-5-(pyrrolidine-1-carbonyl)-1H-pyrazol-1-yl]acetamide
P721-1725 Screening compound: N-(2-chloro-4-fluorophenyl)-2-[3-cyclopropyl-5-(pyrrolidine-1-carbonyl)-1H-pyrazol-1-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P721-1725
N-(2-chloro-4-fluorophenyl)-2-[3-cyclopropyl-5-(pyrrolidine-1-carbonyl)-1H-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

P721-1725

Molecular Formula

C19H20ClFN4O2 (C19 H20 ClFN4 O2)

Compound Name

N-(2-chloro-4-fluorophenyl)-2-[3-cyclopropyl-5-(pyrrolidine-1-carbonyl)-1H-pyrazol-1-yl]acetamide

IUPAC name

N-(2-chloro-4-fluorophenyl)-2-[3-cyclopropyl-5-(pyrrolidine-1-carbonyl)-1H-pyrazol-1-yl]acetamide

SMILES

O=C(Cn1nc(C2CC2)cc1C(N1CCCC1)=O)Nc(ccc(F)c1)c1Cl

InChI

InChI=1S/C19H20ClFN4O2/c20-14-9-13(21)5-6-15(14)22-18(26)11-25-17(10-16(23-25)12-3-4-12)19(27)24-7-1-2-8-24/h5-6,9-10,12H,1-4,7-8,11H2,(H,22,26)

InChI Key

TZQIQNWPMJWHCF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD22597133

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.84

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.149

Distribution Coefficient, logD

3.140

Water Solubility, LogSw

-3.38

Polar Surface Area

52.914

Acid Dissociation Constant (pKa)

9.09

Base Dissociation Constant (pKb)

0.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

P721-1725 in Drug Discovery

Included in Screening Libraries

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

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P721-1725 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P721-1725?
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What is the minimum amount of P721-1725 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P721-1725
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P721-1725
  • 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 P721-1725 available by request