8020-1234 Screening compound: 3-benzyl-1,2-benzisoxazol-6-ol

8020-1234 Screening compound: 3-benzyl-1,2-benzisoxazol-6-ol
8020-1234 Screening compound: 3-benzyl-1,2-benzisoxazol-6-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-1234
3-benzyl-1,2-benzisoxazol-6-ol

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

8020-1234

Molecular Formula

C14H11NO2 (C14 H11 NO2)

Compound Name

3-benzyl-1,2-benzisoxazol-6-ol

IUPAC name

3-benzyl-12-benzoxazol-6-ol

SMILES

Oc(cc1)cc2c1c(Cc1ccccc1)no2

InChI

InChI=1S/C14H11NO2/c16-11-6-7-12-13(15-17-14(12)9-11)8-10-4-2-1-3-5-10/h1-7,9,16H,8H2

InChI Key

PKPHOAWTBCEKQL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12035077

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

225.25

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.159

Distribution Coefficient, logD

3.154

Water Solubility, LogSw

-3.15

Polar Surface Area

40.278

Acid Dissociation Constant (pKa)

9.32

Base Dissociation Constant (pKb)

-4.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.14

8020-1234 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8020-1234 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-1234?
Check Price and Availability of 8020-1234, 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 8020-1234 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-1234
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-1234
  • 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 8020-1234 available by request