V016-6266 Screening compound: N-{[(1,3-diphenyl-1H-pyrazol-5-yl)carbamoyl]methyl}-N-(2-methoxyethyl)-2-(phenylsulfanyl)acetamide

V016-6266 Screening compound: N-{[(1,3-diphenyl-1H-pyrazol-5-yl)carbamoyl]methyl}-N-(2-methoxyethyl)-2-(phenylsulfanyl)acetamide
V016-6266 Screening compound: N-{[(1,3-diphenyl-1H-pyrazol-5-yl)carbamoyl]methyl}-N-(2-methoxyethyl)-2-(phenylsulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-6266
N-{[(1,3-diphenyl-1H-pyrazol-5-yl)carbamoyl]methyl}-N-(2-methoxyethyl)-2-(phenylsulfanyl)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

V016-6266

Molecular Formula

C28H28N4O3S (C28 H28 N4 O3 S)

Compound Name

N-{[(1,3-diphenyl-1H-pyrazol-5-yl)carbamoyl]methyl}-N-(2-methoxyethyl)-2-(phenylsulfanyl)acetamide

IUPAC name

N-{[(13-diphenyl-1H-pyrazol-5-yl)carbamoyl]methyl}-N-(2-methoxyethyl)-2-(phenylsulfanyl)acetamide

SMILES

COCCN(CC(Nc1cc(-c2ccccc2)nn1-c1ccccc1)=O)C(CSc1ccccc1)=O

InChI

InChI=1S/C28H28N4O3S/c1-35-18-17-31(28(34)21-36-24-15-9-4-10-16-24)20-27(33)29-26-19-25(22-11-5-2-6-12-22)30-32(26)23-13-7-3-8-14-23/h2-16,19H,17-18,20-21H2,1H3,(H,29,33)

InChI Key

TWQWSTBJHQBCHP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19716962

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

500.62

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.843

Distribution Coefficient, logD

4.843

Water Solubility, LogSw

-4.52

Polar Surface Area

61.556

Acid Dissociation Constant (pKa)

13.33

Base Dissociation Constant (pKb)

-2.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.86

References: we are preparing a list of scientific research reports with V016-6266 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-6266?
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What is the minimum amount of V016-6266 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-6266
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-6266
  • 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 V016-6266 available by request