V004-0981 Screening compound: N-[(3-ethyl-5-phenoxy-1-phenyl-1H-pyrazol-4-yl)methyl]-N-(2-methoxyethyl)thiophene-2-carboxamide

V004-0981 Screening compound: N-[(3-ethyl-5-phenoxy-1-phenyl-1H-pyrazol-4-yl)methyl]-N-(2-methoxyethyl)thiophene-2-carboxamide
V004-0981 Screening compound: N-[(3-ethyl-5-phenoxy-1-phenyl-1H-pyrazol-4-yl)methyl]-N-(2-methoxyethyl)thiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-0981
N-[(3-ethyl-5-phenoxy-1-phenyl-1H-pyrazol-4-yl)methyl]-N-(2-methoxyethyl)thiophene-2-carboxamide

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

V004-0981

Molecular Formula

C26H27N3O3S (C26 H27 N3 O3 S)

Compound Name

N-[(3-ethyl-5-phenoxy-1-phenyl-1H-pyrazol-4-yl)methyl]-N-(2-methoxyethyl)thiophene-2-carboxamide

IUPAC name

N-[(3-ethyl-5-phenoxy-1-phenyl-1H-pyrazol-4-yl)methyl]-N-(2-methoxyethyl)thiophene-2-carboxamide

SMILES

CCc(c(CN(CCOC)C(c1cccs1)=O)c1Oc2ccccc2)nn1-c1ccccc1

InChI

InChI=1S/C26H27N3O3S/c1-3-23-22(19-28(16-17-31-2)25(30)24-15-10-18-33-24)26(32-21-13-8-5-9-14-21)29(27-23)20-11-6-4-7-12-20/h4-15,18H,3,16-17,19H2,1-2H3

InChI Key

PRYNMANOMGADTF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19805685

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.58

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

5.292

Distribution Coefficient, logD

5.292

Water Solubility, LogSw

-5.25

Polar Surface Area

47.159

Acid Dissociation Constant (pKa)

25.44

Base Dissociation Constant (pKb)

-1.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

References: we are preparing a list of scientific research reports with V004-0981 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-0981?
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What is the minimum amount of V004-0981 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-0981
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-0981
  • 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 V004-0981 available by request