Z318-0880 Screening compound: 2-(3,4-dimethylphenoxy)-N-[4-(4-fluorophenyl)-3-methyl-1H-pyrazol-5-yl]acetamide

Z318-0880 Screening compound: 2-(3,4-dimethylphenoxy)-N-[4-(4-fluorophenyl)-3-methyl-1H-pyrazol-5-yl]acetamide
Z318-0880 Screening compound: 2-(3,4-dimethylphenoxy)-N-[4-(4-fluorophenyl)-3-methyl-1H-pyrazol-5-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Z318-0880
2-(3,4-dimethylphenoxy)-N-[4-(4-fluorophenyl)-3-methyl-1H-pyrazol-5-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

Z318-0880

Molecular Formula

C20H20FN3O2 (C20 H20 FN3 O2)

Compound Name

2-(3,4-dimethylphenoxy)-N-[4-(4-fluorophenyl)-3-methyl-1H-pyrazol-5-yl]acetamide

IUPAC name

2-(34-dimethylphenoxy)-N-[4-(4-fluorophenyl)-3-methyl-1H-pyrazol-5-yl]acetamide

SMILES

Cc1n[nH]c(NC(COc2cc(C)c(C)cc2)=O)c1-c(cc1)ccc1F

InChI

InChI=1S/C20H20FN3O2/c1-12-4-9-17(10-13(12)2)26-11-18(25)22-20-19(14(3)23-24-20)15-5-7-16(21)8-6-15/h4-10H,11H2,1-3H3,(H2,22,23,24,25)

InChI Key

JLDCYRZIRCPOMI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27638481

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

353.4

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.258

Distribution Coefficient, logD

4.258

Water Solubility, LogSw

-4.44

Polar Surface Area

54.322

Acid Dissociation Constant (pKa)

10.87

Base Dissociation Constant (pKb)

0.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

Z318-0880 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 Z318-0880 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Z318-0880?
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What is the minimum amount of Z318-0880 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Z318-0880
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Z318-0880
  • 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 Z318-0880 available by request