8006-2282 Screening compound: 2,4-dichloro-6-[(E)-{[2-(3-methoxyphenyl)-1,3-benzoxazol-5-yl]imino}methyl]phenol

8006-2282 Screening compound: 2,4-dichloro-6-[(E)-{[2-(3-methoxyphenyl)-1,3-benzoxazol-5-yl]imino}methyl]phenol
8006-2282 Screening compound: 2,4-dichloro-6-[(E)-{[2-(3-methoxyphenyl)-1,3-benzoxazol-5-yl]imino}methyl]phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-2282
2,4-dichloro-6-[(E)-{[2-(3-methoxyphenyl)-1,3-benzoxazol-5-yl]imino}methyl]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

8006-2282

Molecular Formula

C21H14Cl2N2O3 (C21 H14 Cl2 N2 O3)

Compound Name

2,4-dichloro-6-[(E)-{[2-(3-methoxyphenyl)-1,3-benzoxazol-5-yl]imino}methyl]phenol

IUPAC name

24-dichloro-6-[(E)-{[2-(3-methoxyphenyl)-13-benzoxazol-5-yl]imino}methyl]phenol

SMILES

COc1cccc(-c2nc(cc(cc3)/N=C/c4cc(Cl)cc(Cl)c4O)c3o2)c1

InChI

InChI=1S/C21H14Cl2N2O3/c1-27-16-4-2-3-12(8-16)21-25-18-10-15(5-6-19(18)28-21)24-11-13-7-14(22)9-17(23)20(13)26/h2-11,26H,1H3

InChI Key

KHUZDCGTIPIIDR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00694897

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.26

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.050

Distribution Coefficient, logD

5.470

Water Solubility, LogSw

-5.82

Polar Surface Area

48.199

Acid Dissociation Constant (pKa)

6.95

Base Dissociation Constant (pKb)

3.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

References: we are preparing a list of scientific research reports with 8006-2282 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-2282?
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What is the minimum amount of 8006-2282 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-2282
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-2282
  • 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 8006-2282 available by request