V006-8606 Screening compound: 3-methyl-N-{[3-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-{[4-(trifluoromethyl)phenyl]methyl}butanamide

V006-8606 Screening compound: 3-methyl-N-{[3-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-{[4-(trifluoromethyl)phenyl]methyl}butanamide
V006-8606 Screening compound: 3-methyl-N-{[3-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-{[4-(trifluoromethyl)phenyl]methyl}butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-8606
3-methyl-N-{[3-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-{[4-(trifluoromethyl)phenyl]methyl}butanamide

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

V006-8606

Molecular Formula

C24H27F3N2O2 (C24 H27 F3 N2 O2)

Compound Name

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

IUPAC name

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

SMILES

CC(C)CC(N(CC(C1)ON=C1c1ccc(C)cc1)Cc1ccc(C(F)(F)F)cc1)=O

InChI

InChI=1S/C24H27F3N2O2/c1-16(2)12-23(30)29(14-18-6-10-20(11-7-18)24(25,26)27)15-21-13-22(28-31-21)19-8-4-17(3)5-9-19/h4-11,16,21H,12-15H2,1-3H3/t21-/m1/s1

InChI Key

VCFKYFAZOQJVQR-OAQYLSRUSA-N

MDL Number (MFCD)

MFCD19777179

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.760

Distribution Coefficient, logD

5.760

Water Solubility, LogSw

-5.53

Polar Surface Area

38.758

Acid Dissociation Constant (pKa)

22.29

Base Dissociation Constant (pKb)

-2.37

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.70

References: we are preparing a list of scientific research reports with V006-8606 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-8606?
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What is the minimum amount of V006-8606 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-8606
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-8606
  • 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 V006-8606 available by request