V020-4259 Screening compound: 4-fluoro-N-(2-methylpropyl)-N-({1-[(pyridin-3-yl)methyl]-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl}methyl)benzamide

V020-4259 Screening compound: 4-fluoro-N-(2-methylpropyl)-N-({1-[(pyridin-3-yl)methyl]-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl}methyl)benzamide
V020-4259 Screening compound: 4-fluoro-N-(2-methylpropyl)-N-({1-[(pyridin-3-yl)methyl]-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl}methyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V020-4259
4-fluoro-N-(2-methylpropyl)-N-({1-[(pyridin-3-yl)methyl]-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-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

V020-4259

Molecular Formula

C29H31F4N3O (C29 H31 F4 N3 O)

Compound Name

4-fluoro-N-(2-methylpropyl)-N-({1-[(pyridin-3-yl)methyl]-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl}methyl)benzamide

IUPAC name

4-fluoro-N-(2-methylpropyl)-N-({1-[(pyridin-3-yl)methyl]-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl}methyl)benzamide

SMILES

CC(C)CN(CC(CN(Cc1cnccc1)C1)C1c1cc(C(F)(F)F)ccc1)C(c(cc1)ccc1F)=O

InChI

InChI=1S/C29H31F4N3O/c1-20(2)15-36(28(37)22-8-10-26(30)11-9-22)18-24-17-35(16-21-5-4-12-34-14-21)19-27(24)23-6-3-7-25(13-23)29(31,32)33/h3-14,20,24,27H,15-19H2,1-2H3

InChI Key

QBHQFXCSRWJHIQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19922453

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

513.58

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.360

Distribution Coefficient, logD

3.192

Water Solubility, LogSw

-5.29

Polar Surface Area

29.661

Acid Dissociation Constant (pKa)

23.12

Base Dissociation Constant (pKb)

9.56

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

37.90

V020-4259 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with V020-4259 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V020-4259?
Check Price and Availability of V020-4259, 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 V020-4259 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V020-4259
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V020-4259
  • 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 V020-4259 available by request