V027-8314 Screening compound: 1-{1-cyclopropanecarbonyl-4-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carbonyl}-4-methylpiperazine

V027-8314 Screening compound: 1-{1-cyclopropanecarbonyl-4-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carbonyl}-4-methylpiperazine
V027-8314 Screening compound: 1-{1-cyclopropanecarbonyl-4-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carbonyl}-4-methylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-8314
1-{1-cyclopropanecarbonyl-4-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carbonyl}-4-methylpiperazine

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

V027-8314

Molecular Formula

C21H26F3N3O2 (C21 H26 F3 N3 O2)

Compound Name

1-{1-cyclopropanecarbonyl-4-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carbonyl}-4-methylpiperazine

IUPAC name

1-{1-cyclopropanecarbonyl-4-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carbonyl}-4-methylpiperazine

SMILES

CN(CC1)CCN1C(C(CN(C1)C(C2CC2)=O)C1c1cccc(C(F)(F)F)c1)=O

InChI

InChI=1S/C21H26F3N3O2/c1-25-7-9-26(10-8-25)20(29)18-13-27(19(28)14-5-6-14)12-17(18)15-3-2-4-16(11-15)21(22,23)24/h2-4,11,14,17-18H,5-10,12-13H2,1H3

InChI Key

XBIYZRIBKXRZOG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19821125

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

409.45

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.435

Distribution Coefficient, logD

2.087

Water Solubility, LogSw

-2.86

Polar Surface Area

37.496

Acid Dissociation Constant (pKa)

21.25

Base Dissociation Constant (pKb)

7.49

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

61.90

V027-8314 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

CNS BBB Library (22607 compounds)

GPCR Targeted Library (31838 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Anti-HIV1 Library (19540 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Hemic and lymphatic
  • Cardiovascular
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V027-8314 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-8314?
Check Price and Availability of V027-8314, 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 V027-8314 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-8314
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-8314
  • 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 V027-8314 available by request