V002-1706 Screening compound: N-[(4-fluorophenyl)methyl]-2-{4-[4-(trifluoromethyl)benzamido]piperidin-1-yl}benzamide

V002-1706 Screening compound: N-[(4-fluorophenyl)methyl]-2-{4-[4-(trifluoromethyl)benzamido]piperidin-1-yl}benzamide
V002-1706 Screening compound: N-[(4-fluorophenyl)methyl]-2-{4-[4-(trifluoromethyl)benzamido]piperidin-1-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-1706
N-[(4-fluorophenyl)methyl]-2-{4-[4-(trifluoromethyl)benzamido]piperidin-1-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

V002-1706

Molecular Formula

C27H25F4N3O2 (C27 H25 F4 N3 O2)

Compound Name

N-[(4-fluorophenyl)methyl]-2-{4-[4-(trifluoromethyl)benzamido]piperidin-1-yl}benzamide

IUPAC name

N-[(4-fluorophenyl)methyl]-2-{4-[4-(trifluoromethyl)benzamido]piperidin-1-yl}benzamide

SMILES

O=C(c1ccc(C(F)(F)F)cc1)NC(CC1)CCN1c(cccc1)c1C(NCc(cc1)ccc1F)=O

InChI

InChI=1S/C27H25F4N3O2/c28-21-11-5-18(6-12-21)17-32-26(36)23-3-1-2-4-24(23)34-15-13-22(14-16-34)33-25(35)19-7-9-20(10-8-19)27(29,30)31/h1-12,22H,13-17H2,(H,32,36)(H,33,35)

InChI Key

NKPLKOUNFCAUCU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19893774

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

499.51

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.181

Distribution Coefficient, logD

5.181

Water Solubility, LogSw

-5.40

Polar Surface Area

51.750

Acid Dissociation Constant (pKa)

10.99

Base Dissociation Constant (pKb)

3.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.90

V002-1706 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with V002-1706 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-1706?
Check Price and Availability of V002-1706, 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 V002-1706 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-1706
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-1706
  • 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 V002-1706 available by request