V008-3554 Screening compound: 5-tert-butyl-2-(3-fluoro-4-methoxyphenyl)-1,3-benzoxazole

V008-3554 Screening compound: 5-tert-butyl-2-(3-fluoro-4-methoxyphenyl)-1,3-benzoxazole
V008-3554 Screening compound: 5-tert-butyl-2-(3-fluoro-4-methoxyphenyl)-1,3-benzoxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-3554
5-tert-butyl-2-(3-fluoro-4-methoxyphenyl)-1,3-benzoxazole

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

V008-3554

Molecular Formula

C18H18FNO2 (C18 H18 FNO2)

Compound Name

5-tert-butyl-2-(3-fluoro-4-methoxyphenyl)-1,3-benzoxazole

IUPAC name

5-tert-butyl-2-(3-fluoro-4-methoxyphenyl)-13-benzoxazole

SMILES

CC(C)(C)c(cc1)cc2c1oc(-c(cc1)cc(F)c1OC)n2

InChI

InChI=1S/C18H18FNO2/c1-18(2,3)12-6-8-16-14(10-12)20-17(22-16)11-5-7-15(21-4)13(19)9-11/h5-10H,1-4H3

InChI Key

KTXDQHCTCRBKPS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19947654

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

299.34

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.163

Distribution Coefficient, logD

5.163

Water Solubility, LogSw

-5.24

Polar Surface Area

24.679

Acid Dissociation Constant (pKa)

30.17

Base Dissociation Constant (pKb)

-0.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

V008-3554 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Immune system
Mechanism of action:
  • Epigenetic
Targets:
  • Others

References: we are preparing a list of scientific research reports with V008-3554 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-3554?
Check Price and Availability of V008-3554, 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 V008-3554 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-3554
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-3554
  • 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 V008-3554 available by request