1315-0405 Screening compound: 4-bromo-2-[(E)-{[2-(2,5-dichlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl]phenol

1315-0405 Screening compound: 4-bromo-2-[(E)-{[2-(2,5-dichlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl]phenol
1315-0405 Screening compound: 4-bromo-2-[(E)-{[2-(2,5-dichlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl]phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 1315-0405
4-bromo-2-[(E)-{[2-(2,5-dichlorophenyl)-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

1315-0405

Molecular Formula

C20H11BrCl2N2O2 (C20 H11 BrCl2 N2 O2)

Compound Name

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

IUPAC name

4-bromo-2-[(E)-{[2-(25-dichlorophenyl)-13-benzoxazol-5-yl]imino}methyl]phenol

SMILES

Oc(cc1)c(/C=N/c(cc2)cc3c2oc(-c(cc(cc2)Cl)c2Cl)n3)cc1Br

InChI

InChI=1S/C20H11BrCl2N2O2/c21-12-1-5-18(26)11(7-12)10-24-14-3-6-19-17(9-14)25-20(27-19)15-8-13(22)2-4-16(15)23/h1-10,26H

InChI Key

RHODNCSFDHJUNA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00581872

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

462.13

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

6.637

Distribution Coefficient, logD

6.574

Water Solubility, LogSw

-6.35

Polar Surface Area

41.724

Acid Dissociation Constant (pKa)

8.21

Base Dissociation Constant (pKb)

3.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 1315-0405 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1315-0405?
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What is the minimum amount of 1315-0405 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1315-0405
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1315-0405
  • 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 1315-0405 available by request