V004-1931 Screening compound: N-{[1-(4-chlorophenyl)-5-(3-fluorophenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}-N-cyclopropylpropanamide

V004-1931 Screening compound: N-{[1-(4-chlorophenyl)-5-(3-fluorophenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}-N-cyclopropylpropanamide
V004-1931 Screening compound: N-{[1-(4-chlorophenyl)-5-(3-fluorophenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}-N-cyclopropylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-1931
N-{[1-(4-chlorophenyl)-5-(3-fluorophenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}-N-cyclopropylpropanamide

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

V004-1931

Molecular Formula

C23H23ClFN3O2 (C23 H23 ClFN3 O2)

Compound Name

N-{[1-(4-chlorophenyl)-5-(3-fluorophenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}-N-cyclopropylpropanamide

IUPAC name

N-{[1-(4-chlorophenyl)-5-(3-fluorophenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}-N-cyclopropylpropanamide

SMILES

CCC(N(Cc(c(C)nn1-c(cc2)ccc2Cl)c1Oc1cc(F)ccc1)C1CC1)=O

InChI

InChI=1S/C23H23ClFN3O2/c1-3-22(29)27(18-11-12-18)14-21-15(2)26-28(19-9-7-16(24)8-10-19)23(21)30-20-6-4-5-17(25)13-20/h4-10,13,18H,3,11-12,14H2,1-2H3

InChI Key

IBWCGLGPMUWNEK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19811673

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.91

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.384

Distribution Coefficient, logD

5.384

Water Solubility, LogSw

-5.89

Polar Surface Area

36.179

Acid Dissociation Constant (pKa)

24.10

Base Dissociation Constant (pKb)

-0.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with V004-1931 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-1931?
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What is the minimum amount of V004-1931 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-1931
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-1931
  • 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 V004-1931 available by request