V029-5842 Screening compound: N-[2-oxo-2-(piperidin-1-yl)-1-{1-[4-(trifluoromethyl)benzoyl]piperidin-4-yl}ethyl]thiophene-2-carboxamide

V029-5842 Screening compound: N-[2-oxo-2-(piperidin-1-yl)-1-{1-[4-(trifluoromethyl)benzoyl]piperidin-4-yl}ethyl]thiophene-2-carboxamide
V029-5842 Screening compound: N-[2-oxo-2-(piperidin-1-yl)-1-{1-[4-(trifluoromethyl)benzoyl]piperidin-4-yl}ethyl]thiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-5842
N-[2-oxo-2-(piperidin-1-yl)-1-{1-[4-(trifluoromethyl)benzoyl]piperidin-4-yl}ethyl]thiophene-2-carboxamide

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

V029-5842

Molecular Formula

C25H28F3N3O3S (C25 H28 F3 N3 O3 S)

Compound Name

N-[2-oxo-2-(piperidin-1-yl)-1-{1-[4-(trifluoromethyl)benzoyl]piperidin-4-yl}ethyl]thiophene-2-carboxamide

IUPAC name

N-[2-oxo-2-(piperidin-1-yl)-1-{1-[4-(trifluoromethyl)benzoyl]piperidin-4-yl}ethyl]thiophene-2-carboxamide

SMILES

O=C(C(C(CC1)CCN1C(c1ccc(C(F)(F)F)cc1)=O)NC(c1cccs1)=O)N1CCCCC1

InChI

InChI=1S/C25H28F3N3O3S/c26-25(27,28)19-8-6-18(7-9-19)23(33)31-14-10-17(11-15-31)21(24(34)30-12-2-1-3-13-30)29-22(32)20-5-4-16-35-20/h4-9,16-17,21H,1-3,10-15H2,(H,29,32)/t21-/m0/s1

InChI Key

INCVFYMVFMSITQ-NRFANRHFSA-N

MDL Number (MFCD)

MFCD19874338

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

507.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.895

Distribution Coefficient, logD

3.895

Water Solubility, LogSw

-4.05

Polar Surface Area

58.319

Acid Dissociation Constant (pKa)

12.14

Base Dissociation Constant (pKb)

3.71

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

48.00

References: we are preparing a list of scientific research reports with V029-5842 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-5842?
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What is the minimum amount of V029-5842 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-5842
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-5842
  • 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 V029-5842 available by request