V010-5667 Screening compound: 2-[(mesitylmethyl)sulfanyl]-N~1~-{3-(methoxymethyl)-4-[3-(trifluoromethyl)phenyl]-5-isoxazolyl}acetamide

V010-5667 Screening compound: 2-[(mesitylmethyl)sulfanyl]-N~1~-{3-(methoxymethyl)-4-[3-(trifluoromethyl)phenyl]-5-isoxazolyl}acetamide
V010-5667 Screening compound: 2-[(mesitylmethyl)sulfanyl]-N~1~-{3-(methoxymethyl)-4-[3-(trifluoromethyl)phenyl]-5-isoxazolyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V010-5667
2-[(mesitylmethyl)sulfanyl]-N~1~-{3-(methoxymethyl)-4-[3-(trifluoromethyl)phenyl]-5-isoxazolyl}acetamide

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

V010-5667

Molecular Formula

C24H25F3N2O3S (C24 H25 F3 N2 O3 S)

Compound Name

2-[(mesitylmethyl)sulfanyl]-N~1~-{3-(methoxymethyl)-4-[3-(trifluoromethyl)phenyl]-5-isoxazolyl}acetamide

IUPAC name

N-[3-(methoxymethyl)-4-[3-(trifluoromethyl)phenyl]-12-oxazol-5-yl]-2-{[(246-trimethylphenyl)methyl]sulfanyl}acetamide

SMILES

Cc1cc(C)c(CSCC(Nc(onc2COC)c2-c2cc(C(F)(F)F)ccc2)=O)c(C)c1

InChI

InChI=1S/C24H25F3N2O3S/c1-14-8-15(2)19(16(3)9-14)12-33-13-21(30)28-23-22(20(11-31-4)29-32-23)17-6-5-7-18(10-17)24(25,26)27/h5-10H,11-13H2,1-4H3,(H,28,30)

InChI Key

MCMMZXSPYUQTLS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19956111

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.115

Distribution Coefficient, logD

6.097

Water Solubility, LogSw

-5.68

Polar Surface Area

54.622

Acid Dissociation Constant (pKa)

8.76

Base Dissociation Constant (pKb)

-4.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.33

References: we are preparing a list of scientific research reports with V010-5667 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V010-5667?
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What is the minimum amount of V010-5667 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V010-5667
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V010-5667
  • 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 V010-5667 available by request