8005-6256 Screening compound: 2-bromo-6-[(E)-{[2-(2,3-dichlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl]-4-methylphenol

8005-6256 Screening compound: 2-bromo-6-[(E)-{[2-(2,3-dichlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl]-4-methylphenol
8005-6256 Screening compound: 2-bromo-6-[(E)-{[2-(2,3-dichlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl]-4-methylphenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8005-6256
2-bromo-6-[(E)-{[2-(2,3-dichlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl]-4-methylphenol

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

8005-6256

Molecular Formula

C21H13BrCl2N2O2 (C21 H13 BrCl2 N2 O2)

Compound Name

2-bromo-6-[(E)-{[2-(2,3-dichlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl]-4-methylphenol

IUPAC name

2-bromo-6-[(E)-{[2-(23-dichlorophenyl)-13-benzoxazol-5-yl]imino}methyl]-4-methylphenol

SMILES

Cc(cc1/C=N/c(cc2)cc3c2oc(-c(cccc2Cl)c2Cl)n3)cc(Br)c1O

InChI

InChI=1S/C21H13BrCl2N2O2/c1-11-7-12(20(27)15(22)8-11)10-25-13-5-6-18-17(9-13)26-21(28-18)14-3-2-4-16(23)19(14)24/h2-10,27H,1H3

InChI Key

XXSKUMCQWQIFPL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00820980

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476.16

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

6.875

Distribution Coefficient, logD

6.698

Water Solubility, LogSw

-6.26

Polar Surface Area

40.655

Acid Dissociation Constant (pKa)

7.70

Base Dissociation Constant (pKb)

4.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

References: we are preparing a list of scientific research reports with 8005-6256 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8005-6256?
Check Price and Availability of 8005-6256, 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 8005-6256 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8005-6256
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8005-6256
  • 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 8005-6256 available by request