V004-4786 Screening compound: N-(4-phenylbutan-2-yl)-4-{3-[4-(piperidin-1-yl)phenyl]-1H-pyrazol-5-yl}benzamide

V004-4786 Screening compound: N-(4-phenylbutan-2-yl)-4-{3-[4-(piperidin-1-yl)phenyl]-1H-pyrazol-5-yl}benzamide
V004-4786 Screening compound: N-(4-phenylbutan-2-yl)-4-{3-[4-(piperidin-1-yl)phenyl]-1H-pyrazol-5-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-4786
N-(4-phenylbutan-2-yl)-4-{3-[4-(piperidin-1-yl)phenyl]-1H-pyrazol-5-yl}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

V004-4786

Molecular Formula

C31H34N4O (C31 H34 N4 O)

Compound Name

N-(4-phenylbutan-2-yl)-4-{3-[4-(piperidin-1-yl)phenyl]-1H-pyrazol-5-yl}benzamide

IUPAC name

N-(4-phenylbutan-2-yl)-4-{3-[4-(piperidin-1-yl)phenyl]-1H-pyrazol-5-yl}benzamide

SMILES

CC(CCc1ccccc1)NC(c(cc1)ccc1-c1cc(-c(cc2)ccc2N2CCCCC2)n[nH]1)=O

InChI

InChI=1S/C31H34N4O/c1-23(10-11-24-8-4-2-5-9-24)32-31(36)27-14-12-25(13-15-27)29-22-30(34-33-29)26-16-18-28(19-17-26)35-20-6-3-7-21-35/h2,4-5,8-9,12-19,22-23H,3,6-7,10-11,20-21H2,1H3,(H,32,36)(H,33,34)/t23-/m0/s1

InChI Key

YFFOEZANOBLUMT-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD19954251

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

478.64

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.561

Distribution Coefficient, logD

6.561

Water Solubility, LogSw

-5.56

Polar Surface Area

49.764

Acid Dissociation Constant (pKa)

12.69

Base Dissociation Constant (pKb)

8.16

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

29.00

V004-4786 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Glucocorticoid receptors Library (4806 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands
  • Epigenetic

References: we are preparing a list of scientific research reports with V004-4786 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-4786?
Check Price and Availability of V004-4786, 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 V004-4786 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-4786
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-4786
  • 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 V004-4786 available by request