V011-4806 Screening compound: 2-fluoro-N-{2-[5-(4-fluorophenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)benzamide

V011-4806 Screening compound: 2-fluoro-N-{2-[5-(4-fluorophenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)benzamide
V011-4806 Screening compound: 2-fluoro-N-{2-[5-(4-fluorophenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-4806
2-fluoro-N-{2-[5-(4-fluorophenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-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

V011-4806

Molecular Formula

C28H27F2N3O4 (C28 H27 F2 N3 O4)

Compound Name

2-fluoro-N-{2-[5-(4-fluorophenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)benzamide

IUPAC name

2-fluoro-N-{2-[5-(4-fluorophenyl)-3-(4-methoxyphenyl)-45-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)benzamide

SMILES

COCCN(CC(N(C(C1)c(cc2)ccc2F)N=C1c(cc1)ccc1OC)=O)C(c(cccc1)c1F)=O

InChI

InChI=1S/C28H27F2N3O4/c1-36-16-15-32(28(35)23-5-3-4-6-24(23)30)18-27(34)33-26(20-7-11-21(29)12-8-20)17-25(31-33)19-9-13-22(37-2)14-10-19/h3-14,26H,15-18H2,1-2H3/t26-/m0/s1

InChI Key

VHZAQURLZGDMNQ-SANMLTNESA-N

MDL Number (MFCD)

MFCD19800371

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

507.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.272

Distribution Coefficient, logD

4.272

Water Solubility, LogSw

-4.27

Polar Surface Area

58.934

Acid Dissociation Constant (pKa)

18.65

Base Dissociation Constant (pKb)

1.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with V011-4806 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-4806?
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What is the minimum amount of V011-4806 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-4806
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-4806
  • 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 V011-4806 available by request