V010-8733 Screening compound: 4-chloro-N-{[3-ethyl-5-(4-fluorophenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]benzamide

V010-8733 Screening compound: 4-chloro-N-{[3-ethyl-5-(4-fluorophenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]benzamide
V010-8733 Screening compound: 4-chloro-N-{[3-ethyl-5-(4-fluorophenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-8733
4-chloro-N-{[3-ethyl-5-(4-fluorophenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]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

V010-8733

Molecular Formula

C30H29ClFN3O3 (C30 H29 ClFN3 O3)

Compound Name

4-chloro-N-{[3-ethyl-5-(4-fluorophenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]benzamide

IUPAC name

4-chloro-N-{[3-ethyl-5-(4-fluorophenoxy)-1-phenyl-1H-pyrazol-4-yl]methyl}-N-[(oxolan-2-yl)methyl]benzamide

SMILES

CCc(c(CN(CC1OCCC1)C(c(cc1)ccc1Cl)=O)c1Oc(cc2)ccc2F)nn1-c1ccccc1

InChI

InChI=1S/C30H29ClFN3O3/c1-2-28-27(20-34(19-26-9-6-18-37-26)29(36)21-10-12-22(31)13-11-21)30(38-25-16-14-23(32)15-17-25)35(33-28)24-7-4-3-5-8-24/h3-5,7-8,10-17,26H,2,6,9,18-20H2,1H3/t26-/m1/s1

InChI Key

SKPSIEYHHCQGRA-AREMUKBSSA-N

MDL Number (MFCD)

MFCD19810276

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

534.03

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.987

Distribution Coefficient, logD

5.987

Water Solubility, LogSw

-6.17

Polar Surface Area

46.203

Acid Dissociation Constant (pKa)

24.57

Base Dissociation Constant (pKb)

-1.45

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.70

V010-8733 in Drug Discovery

Included in Screening Libraries

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V010-8733 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-8733?
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What is the minimum amount of V010-8733 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-8733
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-8733
  • 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 V010-8733 available by request