V026-5073 Screening compound: N-{[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-{[3-(trifluoromethyl)phenyl]methyl}cyclopentanecarboxamide

V026-5073 Screening compound: N-{[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-{[3-(trifluoromethyl)phenyl]methyl}cyclopentanecarboxamide
V026-5073 Screening compound: N-{[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-{[3-(trifluoromethyl)phenyl]methyl}cyclopentanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-5073
N-{[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-{[3-(trifluoromethyl)phenyl]methyl}cyclopentanecarboxamide

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

V026-5073

Molecular Formula

C24H24ClF3N2O2 (C24 H24 ClF3 N2 O2)

Compound Name

N-{[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-{[3-(trifluoromethyl)phenyl]methyl}cyclopentanecarboxamide

IUPAC name

N-{[3-(4-chlorophenyl)-45-dihydro-12-oxazol-5-yl]methyl}-N-{[3-(trifluoromethyl)phenyl]methyl}cyclopentanecarboxamide

SMILES

O=C(C1CCCC1)N(CC(C1)ON=C1c(cc1)ccc1Cl)Cc1cc(C(F)(F)F)ccc1

InChI

InChI=1S/C24H24ClF3N2O2/c25-20-10-8-17(9-11-20)22-13-21(32-29-22)15-30(23(31)18-5-1-2-6-18)14-16-4-3-7-19(12-16)24(26,27)28/h3-4,7-12,18,21H,1-2,5-6,13-15H2/t21-/m0/s1

InChI Key

LAMUQVFDEQRHLN-NRFANRHFSA-N

MDL Number (MFCD)

MFCD19798426

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

464.91

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.027

Distribution Coefficient, logD

6.027

Water Solubility, LogSw

-6.50

Polar Surface Area

39.572

Acid Dissociation Constant (pKa)

22.29

Base Dissociation Constant (pKb)

-3.81

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.70

V026-5073 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V026-5073 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-5073?
Check Price and Availability of V026-5073, 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 V026-5073 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-5073
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-5073
  • 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 V026-5073 available by request