8015-4613 Screening compound: 2-(3-bromo-4-iodophenyl)-4-[(Z)-1-(2,3-dimethoxyphenyl)methylidene]-1,3-oxazol-5-one
Chemical Structure Depiction of ChemDiv screening compound 8015-4613
2-(3-bromo-4-iodophenyl)-4-[(Z)-1-(2,3-dimethoxyphenyl)methylidene]-1,3-oxazol-5-one
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
8015-4613
Molecular Formula
C18H13BrINO4 (C18 H13 BrINO4)
Compound Name
2-(3-bromo-4-iodophenyl)-4-[(Z)-1-(2,3-dimethoxyphenyl)methylidene]-1,3-oxazol-5-one
IUPAC name
n/a
SMILES
COc1cccc(/C=C2\N=C(c(cc3)cc(Br)c3I)OC2=O)c1OC
InChI Key
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
514.11
Hydrogen Bond Acceptors Count
6.00
Hydrogen Bond Donors Count
0.00
Rotatable Bond Count
4.00
Number of Nitrogen and Oxygen Atoms
5
Partition Coefficient, logP
4.777
Distribution Coefficient, logD
4.777
Water Solubility, LogSw
-4.82
Polar Surface Area
45.723
Acid Dissociation Constant (pKa)
33.29
Base Dissociation Constant (pKb)
-0.36
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
11.10
References: we are preparing a list of scientific research reports with 8015-4613 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)