V008-2659 Screening compound: 2,6-dimethoxy-4-{6-[4-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-yl}phenyl acetate

V008-2659 Screening compound: 2,6-dimethoxy-4-{6-[4-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-yl}phenyl acetate
V008-2659 Screening compound: 2,6-dimethoxy-4-{6-[4-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-yl}phenyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-2659
2,6-dimethoxy-4-{6-[4-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-yl}phenyl acetate

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

V008-2659

Molecular Formula

C24H18F3NO5 (C24 H18 F3 NO5)

Compound Name

2,6-dimethoxy-4-{6-[4-(trifluoromethyl)phenyl]-1,3-benzoxazol-2-yl}phenyl acetate

IUPAC name

26-dimethoxy-4-{6-[4-(trifluoromethyl)phenyl]-13-benzoxazol-2-yl}phenyl acetate

SMILES

CC(Oc(c(OC)cc(-c1nc(ccc(-c2ccc(C(F)(F)F)cc2)c2)c2o1)c1)c1OC)=O

InChI

InChI=1S/C24H18F3NO5/c1-13(29)32-22-20(30-2)11-16(12-21(22)31-3)23-28-18-9-6-15(10-19(18)33-23)14-4-7-17(8-5-14)24(25,26)27/h4-12H,1-3H3

InChI Key

WOUKDZRIRIOKRZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19951134

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.666

Distribution Coefficient, logD

5.666

Water Solubility, LogSw

-5.58

Polar Surface Area

52.962

Acid Dissociation Constant (pKa)

22.67

Base Dissociation Constant (pKb)

2.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

V008-2659 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Bromodomain Modulators Library (5801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with V008-2659 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-2659?
Check Price and Availability of V008-2659, 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 V008-2659 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-2659
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-2659
  • 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 V008-2659 available by request