V030-9126 Screening compound: 3-phenyl-4-[(pyrrolidin-1-yl)methyl]-1-[3-(trifluoromethyl)benzoyl]pyrrolidine

V030-9126 Screening compound: 3-phenyl-4-[(pyrrolidin-1-yl)methyl]-1-[3-(trifluoromethyl)benzoyl]pyrrolidine
V030-9126 Screening compound: 3-phenyl-4-[(pyrrolidin-1-yl)methyl]-1-[3-(trifluoromethyl)benzoyl]pyrrolidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-9126
3-phenyl-4-[(pyrrolidin-1-yl)methyl]-1-[3-(trifluoromethyl)benzoyl]pyrrolidine

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

V030-9126

Molecular Formula

C23H25F3N2O (C23 H25 F3 N2 O)

Compound Name

3-phenyl-4-[(pyrrolidin-1-yl)methyl]-1-[3-(trifluoromethyl)benzoyl]pyrrolidine

IUPAC name

3-phenyl-4-[(pyrrolidin-1-yl)methyl]-1-[3-(trifluoromethyl)benzoyl]pyrrolidine

SMILES

O=C(c1cccc(C(F)(F)F)c1)N(CC1CN2CCCC2)CC1c1ccccc1

InChI

InChI=1S/C23H25F3N2O/c24-23(25,26)20-10-6-9-18(13-20)22(29)28-15-19(14-27-11-4-5-12-27)21(16-28)17-7-2-1-3-8-17/h1-3,6-10,13,19,21H,4-5,11-12,14-16H2

InChI Key

NDWQJGLFBWMODB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19922001

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

402.46

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.155

Distribution Coefficient, logD

1.088

Water Solubility, LogSw

-4.34

Polar Surface Area

20.947

Acid Dissociation Constant (pKa)

23.81

Base Dissociation Constant (pKb)

10.47

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

43.48

V030-9126 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Anti-HIV1 Library (19540 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
  • Nervous system
  • Antiviral
  • Infections
  • Immune system
Targets:
  • GPCR
  • Ion Channels
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V030-9126 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-9126?
Check Price and Availability of V030-9126, 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 V030-9126 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-9126
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-9126
  • 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 V030-9126 available by request