(4Z)-4-benzylidene-3-(4-chlorophenyl)-1,3-oxazolidin-2-one

C16H12ClNO2 — CID 134098311

IUPAC(4Z)-4-benzylidene-3-(4-chlorophenyl)-1,3-oxazolidin-2-one
SMILESO=C1OC/C(=C/c2ccccc2)N1c1ccc(Cl)cc1
InChIInChI=1S/C16H12ClNO2/c17-13-6-8-14(9-7-13)18-15(11-20-16(18)19)10-12-4-2-1-3-5-12/h1-10H,11H2/b15-10-
InChIKeyBRUXYAURKSDHMF-GDNBJRDFSA-N
MW285.73 g/mol
LogP4.34
Rot. Bonds2

About (4Z)-4-benzylidene-3-(4-chlorophenyl)-1,3-oxazolidin-2-one

(4Z)-4-benzylidene-3-(4-chlorophenyl)-1,3-oxazolidin-2-one (PubChem CID 134098311) has the molecular formula C16H12ClNO2 and a molecular weight of 285.73 g/mol. Its IUPAC name is (4Z)-4-benzylidene-3-(4-chlorophenyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(4Z)-4-benzylidene-3-(4-chlorophenyl)-1,3-oxazolidin-2-one
PubChem CID134098311
Molecular FormulaC16H12ClNO2
Molecular Weight285.73 g/mol
Exact Mass285.06
IUPAC Name(4Z)-4-benzylidene-3-(4-chlorophenyl)-1,3-oxazolidin-2-one
SMILESO=C1OC/C(=C/c2ccccc2)N1c1ccc(Cl)cc1
InChIInChI=1S/C16H12ClNO2/c17-13-6-8-14(9-7-13)18-15(11-20-16(18)19)10-12-4-2-1-3-5-12/h1-10H,11H2/b15-10-
InChIKeyBRUXYAURKSDHMF-GDNBJRDFSA-N
XLogP4.34
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.73
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4Z)-4-benzylidene-3-(4-chlorophenyl)-1,3-oxazolidin-2-one?
The IUPAC name of (4Z)-4-benzylidene-3-(4-chlorophenyl)-1,3-oxazolidin-2-one (CID 134098311) is (4Z)-4-benzylidene-3-(4-chlorophenyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for (4Z)-4-benzylidene-3-(4-chlorophenyl)-1,3-oxazolidin-2-one?
The canonical SMILES for (4Z)-4-benzylidene-3-(4-chlorophenyl)-1,3-oxazolidin-2-one is O=C1OC/C(=C/c2ccccc2)N1c1ccc(Cl)cc1.
What is the InChIKey of (4Z)-4-benzylidene-3-(4-chlorophenyl)-1,3-oxazolidin-2-one?
The InChIKey is BRUXYAURKSDHMF-GDNBJRDFSA-N. The full InChI is InChI=1S/C16H12ClNO2/c17-13-6-8-14(9-7-13)18-15(11-20-16(18)19)10-12-4-2-1-3-5-12/h1-10H,11H2/b15-10-.
What are the key properties of (4Z)-4-benzylidene-3-(4-chlorophenyl)-1,3-oxazolidin-2-one?
(4Z)-4-benzylidene-3-(4-chlorophenyl)-1,3-oxazolidin-2-one has a molecular weight of 285.73 g/mol, XLogP of 4.34, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-4-benzylidene-3-(4-chlorophenyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 134098311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).