V031-1101 Screening compound: 4-benzyl-1-{5-[3-(trifluoromethyl)phenyl]-1,2-oxazole-3-carbonyl}piperidine

V031-1101 Screening compound: 4-benzyl-1-{5-[3-(trifluoromethyl)phenyl]-1,2-oxazole-3-carbonyl}piperidine
V031-1101 Screening compound: 4-benzyl-1-{5-[3-(trifluoromethyl)phenyl]-1,2-oxazole-3-carbonyl}piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V031-1101
4-benzyl-1-{5-[3-(trifluoromethyl)phenyl]-1,2-oxazole-3-carbonyl}piperidine

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

V031-1101

Molecular Formula

C23H21F3N2O2 (C23 H21 F3 N2 O2)

Compound Name

4-benzyl-1-{5-[3-(trifluoromethyl)phenyl]-1,2-oxazole-3-carbonyl}piperidine

IUPAC name

4-benzyl-1-{5-[3-(trifluoromethyl)phenyl]-12-oxazole-3-carbonyl}piperidine

SMILES

O=C(c1noc(-c2cccc(C(F)(F)F)c2)c1)N1CCC(Cc2ccccc2)CC1

InChI

InChI=1S/C23H21F3N2O2/c24-23(25,26)19-8-4-7-18(14-19)21-15-20(27-30-21)22(29)28-11-9-17(10-12-28)13-16-5-2-1-3-6-16/h1-8,14-15,17H,9-13H2

InChI Key

HNVLJRZZBRCPSZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19954892

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

414.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.774

Distribution Coefficient, logD

5.774

Water Solubility, LogSw

-6.20

Polar Surface Area

38.150

Acid Dissociation Constant (pKa)

25.45

Base Dissociation Constant (pKb)

-3.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with V031-1101 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V031-1101?
Check Price and Availability of V031-1101, 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 V031-1101 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V031-1101
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V031-1101
  • 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 V031-1101 available by request