V030-7043 Screening compound: 4-methyl-2-(4-methyl-1,3-benzoxazol-2-yl)phenyl 2-(trifluoromethoxy)benzene-1-sulfonate

V030-7043 Screening compound: 4-methyl-2-(4-methyl-1,3-benzoxazol-2-yl)phenyl 2-(trifluoromethoxy)benzene-1-sulfonate
V030-7043 Screening compound: 4-methyl-2-(4-methyl-1,3-benzoxazol-2-yl)phenyl 2-(trifluoromethoxy)benzene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-7043
4-methyl-2-(4-methyl-1,3-benzoxazol-2-yl)phenyl 2-(trifluoromethoxy)benzene-1-sulfonate

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

V030-7043

Molecular Formula

C22H16F3NO5S (C22 H16 F3 NO5 S)

Compound Name

4-methyl-2-(4-methyl-1,3-benzoxazol-2-yl)phenyl 2-(trifluoromethoxy)benzene-1-sulfonate

IUPAC name

4-methyl-2-(4-methyl-13-benzoxazol-2-yl)phenyl 2-(trifluoromethoxy)benzene-1-sulfonate

SMILES

Cc(cc1)cc(-c2nc(c(C)ccc3)c3o2)c1OS(c(cccc1)c1OC(F)(F)F)(=O)=O

InChI

InChI=1S/C22H16F3NO5S/c1-13-10-11-16(15(12-13)21-26-20-14(2)6-5-8-18(20)29-21)31-32(27,28)19-9-4-3-7-17(19)30-22(23,24)25/h3-12H,1-2H3

InChI Key

AEWPZJAOJHBEJO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19794881

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

463.43

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.292

Distribution Coefficient, logD

6.292

Water Solubility, LogSw

-5.75

Polar Surface Area

59.691

Acid Dissociation Constant (pKa)

24.69

Base Dissociation Constant (pKb)

-0.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

References: we are preparing a list of scientific research reports with V030-7043 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-7043?
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What is the minimum amount of V030-7043 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-7043
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-7043
  • 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 V030-7043 available by request