0632-0833 Screening compound: 4-[(1E)-2-(5-nitro-1,3-benzoxazol-2-yl)ethenyl]phenol

0632-0833 Screening compound: 4-[(1E)-2-(5-nitro-1,3-benzoxazol-2-yl)ethenyl]phenol
0632-0833 Screening compound: 4-[(1E)-2-(5-nitro-1,3-benzoxazol-2-yl)ethenyl]phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 0632-0833
4-[(1E)-2-(5-nitro-1,3-benzoxazol-2-yl)ethenyl]phenol

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

0632-0833

Molecular Formula

C15H10N2O4 (C15 H10 N2 O4)

Compound Name

4-[(1E)-2-(5-nitro-1,3-benzoxazol-2-yl)ethenyl]phenol

IUPAC name

4-[(1E)-2-(5-nitro-13-benzoxazol-2-yl)ethenyl]phenol

SMILES

[O-][N+](c(cc1)cc2c1oc(/C=C/c(cc1)ccc1O)n2)=O

InChI

InChI=1S/C15H10N2O4/c18-12-5-1-10(2-6-12)3-8-15-16-13-9-11(17(19)20)4-7-14(13)21-15/h1-9,18H

InChI Key

MAPBZSMGYXETSE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00413704

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

282.26

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.709

Distribution Coefficient, logD

3.706

Water Solubility, LogSw

-4.13

Polar Surface Area

67.713

Acid Dissociation Constant (pKa)

9.67

Base Dissociation Constant (pKb)

-5.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0632-0833 in Drug Discovery

Included in Screening Libraries

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 0632-0833 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0632-0833?
Check Price and Availability of 0632-0833, 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 0632-0833 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0632-0833
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0632-0833
  • 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 0632-0833 available by request