V026-0812 Screening compound: N-{[3-ethyl-1-(4-fluorophenyl)-5-(3-methylphenoxy)-1H-pyrazol-4-yl]methyl}-2-fluoro-N-(2-methoxyethyl)benzamide

V026-0812 Screening compound: N-{[3-ethyl-1-(4-fluorophenyl)-5-(3-methylphenoxy)-1H-pyrazol-4-yl]methyl}-2-fluoro-N-(2-methoxyethyl)benzamide
V026-0812 Screening compound: N-{[3-ethyl-1-(4-fluorophenyl)-5-(3-methylphenoxy)-1H-pyrazol-4-yl]methyl}-2-fluoro-N-(2-methoxyethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-0812
N-{[3-ethyl-1-(4-fluorophenyl)-5-(3-methylphenoxy)-1H-pyrazol-4-yl]methyl}-2-fluoro-N-(2-methoxyethyl)benzamide

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

V026-0812

Molecular Formula

C29H29F2N3O3 (C29 H29 F2 N3 O3)

Compound Name

N-{[3-ethyl-1-(4-fluorophenyl)-5-(3-methylphenoxy)-1H-pyrazol-4-yl]methyl}-2-fluoro-N-(2-methoxyethyl)benzamide

IUPAC name

N-{[3-ethyl-1-(4-fluorophenyl)-5-(3-methylphenoxy)-1H-pyrazol-4-yl]methyl}-2-fluoro-N-(2-methoxyethyl)benzamide

SMILES

CCc(c(CN(CCOC)C(c(cccc1)c1F)=O)c1Oc2cc(C)ccc2)nn1-c(cc1)ccc1F

InChI

InChI=1S/C29H29F2N3O3/c1-4-27-25(19-33(16-17-36-3)28(35)24-10-5-6-11-26(24)31)29(37-23-9-7-8-20(2)18-23)34(32-27)22-14-12-21(30)13-15-22/h5-15,18H,4,16-17,19H2,1-3H3

InChI Key

AXLKSOOQSZMIHW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19809097

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

505.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.876

Distribution Coefficient, logD

5.876

Water Solubility, LogSw

-5.54

Polar Surface Area

46.141

Acid Dissociation Constant (pKa)

24.37

Base Dissociation Constant (pKb)

-1.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.10

References: we are preparing a list of scientific research reports with V026-0812 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-0812?
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What is the minimum amount of V026-0812 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-0812
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-0812
  • 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 V026-0812 available by request