8019-7255 Screening compound: 5-[(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-N'-[(Z)-(4-fluorophenyl)methylidene]-4,5-dihydro-1,2-oxazole-3-carbohydrazide

8019-7255 Screening compound: 5-[(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-N'-[(Z)-(4-fluorophenyl)methylidene]-4,5-dihydro-1,2-oxazole-3-carbohydrazide
8019-7255 Screening compound: 5-[(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-N'-[(Z)-(4-fluorophenyl)methylidene]-4,5-dihydro-1,2-oxazole-3-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-7255
5-[(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-N'-[(Z)-(4-fluorophenyl)methylidene]-4,5-dihydro-1,2-oxazole-3-carbohydrazide

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

8019-7255

Molecular Formula

C21H19BrFN3O6 (C21 H19 BrFN3 O6)

Compound Name

5-[(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-N'-[(Z)-(4-fluorophenyl)methylidene]-4,5-dihydro-1,2-oxazole-3-carbohydrazide

IUPAC name

5-[(6-bromo-47-dimethoxy-2H-13-benzodioxol-5-yl)methyl]-N'-[(Z)-(4-fluorophenyl)methylidene]-45-dihydro-12-oxazole-3-carbohydrazide

SMILES

COc(c1c2OCO1)c(CC(C1)ON=C1C(N/N=C\c(cc1)ccc1F)=O)c(Br)c2OC

InChI

InChI=1S/C21H19BrFN3O6/c1-28-17-14(16(22)18(29-2)20-19(17)30-10-31-20)7-13-8-15(26-32-13)21(27)25-24-9-11-3-5-12(23)6-4-11/h3-6,9,13H,7-8,10H2,1-2H3,(H,25,27)/t13-/m0/s1

InChI Key

VULRSVHFQOCICZ-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD10039219

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

508.3

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.116

Distribution Coefficient, logD

4.077

Water Solubility, LogSw

-4.33

Polar Surface Area

90.308

Acid Dissociation Constant (pKa)

8.44

Base Dissociation Constant (pKb)

-5.79

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

28.60

References: we are preparing a list of scientific research reports with 8019-7255 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-7255?
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Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-7255
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-7255
  • 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 8019-7255 available by request