C795-0662 Screening compound: 4-ethyl-N-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methyl}aniline

C795-0662 Screening compound: 4-ethyl-N-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methyl}aniline
C795-0662 Screening compound: 4-ethyl-N-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methyl}aniline alternative view

Chemical Structure Depiction of ChemDiv screening compound C795-0662
4-ethyl-N-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methyl}aniline

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

C795-0662

Molecular Formula

C22H21N3S (C22 H21 N3 S)

Compound Name

4-ethyl-N-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methyl}aniline

IUPAC name

4-ethyl-N-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methyl}aniline

SMILES

CCc(cc1)ccc1NCc1cn(-c2ccccc2)nc1-c1cccs1

InChI

InChI=1S/C22H21N3S/c1-2-17-10-12-19(13-11-17)23-15-18-16-25(20-7-4-3-5-8-20)24-22(18)21-9-6-14-26-21/h3-14,16,23H,2,15H2,1H3

InChI Key

NFUCYHOVNOKRTA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14797013

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

359.49

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.896

Distribution Coefficient, logD

5.896

Water Solubility, LogSw

-5.67

Polar Surface Area

26.124

Acid Dissociation Constant (pKa)

20.09

Base Dissociation Constant (pKb)

8.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

C795-0662 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C795-0662 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C795-0662?
Check Price and Availability of C795-0662, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C795-0662 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C795-0662
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C795-0662
  • 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 C795-0662 available by request