V007-5400 Screening compound: 3-bromo-2-(5-tert-butyl-1,3-benzoxazol-2-yl)-6-methoxyphenol

V007-5400 Screening compound: 3-bromo-2-(5-tert-butyl-1,3-benzoxazol-2-yl)-6-methoxyphenol
V007-5400 Screening compound: 3-bromo-2-(5-tert-butyl-1,3-benzoxazol-2-yl)-6-methoxyphenol alternative view

Chemical Structure Depiction of ChemDiv screening compound V007-5400
3-bromo-2-(5-tert-butyl-1,3-benzoxazol-2-yl)-6-methoxyphenol

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

V007-5400

Molecular Formula

C18H18BrNO3 (C18 H18 BrNO3)

Compound Name

3-bromo-2-(5-tert-butyl-1,3-benzoxazol-2-yl)-6-methoxyphenol

IUPAC name

3-bromo-2-(5-tert-butyl-13-benzoxazol-2-yl)-6-methoxyphenol

SMILES

CC(C)(C)c(cc1)cc2c1oc(-c(c(O)c(cc1)OC)c1Br)n2

InChI

InChI=1S/C18H18BrNO3/c1-18(2,3)10-5-7-13-12(9-10)20-17(23-13)15-11(19)6-8-14(22-4)16(15)21/h5-9,21H,1-4H3

InChI Key

YEMWNJUSSNYUOZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19951159

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

376.25

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.352

Distribution Coefficient, logD

5.341

Water Solubility, LogSw

-5.49

Polar Surface Area

40.158

Acid Dissociation Constant (pKa)

9.01

Base Dissociation Constant (pKb)

1.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

V007-5400 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V007-5400 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V007-5400?
Check Price and Availability of V007-5400, 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 V007-5400 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V007-5400
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V007-5400
  • 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 V007-5400 available by request