(5E)-3-ethyl-5-[(9-ethylcarbazol-3-yl)methylidene]-2-phenylimino-1,3-oxazolidin-4-one

C26H23N3O2 — CID 58958967

IUPAC(5E)-3-ethyl-5-[(9-ethylcarbazol-3-yl)methylidene]-2-phenylimino-1,3-oxazolidin-4-one
SMILESCCN1C(=O)/C(=C\c2ccc3c(c2)c2ccccc2n3CC)O/C1=N\c1ccccc1
InChIInChI=1S/C26H23N3O2/c1-3-28-22-13-9-8-12-20(22)21-16-18(14-15-23(21)28)17-24-25(30)29(4-2)26(31-24)27-19-10-6-5-7-11-19/h5-17H,3-4H2,1-2H3/b24-17+,27-26-
InChIKeyGZRCCUDQLHNDGY-UINIZAEWSA-N
MW409.49 g/mol
LogP5.72
Rot. Bonds4

About (5E)-3-ethyl-5-[(9-ethylcarbazol-3-yl)methylidene]-2-phenylimino-1,3-oxazolidin-4-one

(5E)-3-ethyl-5-[(9-ethylcarbazol-3-yl)methylidene]-2-phenylimino-1,3-oxazolidin-4-one (PubChem CID 58958967) has the molecular formula C26H23N3O2 and a molecular weight of 409.49 g/mol. Its IUPAC name is (5E)-3-ethyl-5-[(9-ethylcarbazol-3-yl)methylidene]-2-phenylimino-1,3-oxazolidin-4-one.

Molecular Properties

Compound Name(5E)-3-ethyl-5-[(9-ethylcarbazol-3-yl)methylidene]-2-phenylimino-1,3-oxazolidin-4-one
PubChem CID58958967
Molecular FormulaC26H23N3O2
Molecular Weight409.49 g/mol
Exact Mass409.18
IUPAC Name(5E)-3-ethyl-5-[(9-ethylcarbazol-3-yl)methylidene]-2-phenylimino-1,3-oxazolidin-4-one
SMILESCCN1C(=O)/C(=C\c2ccc3c(c2)c2ccccc2n3CC)O/C1=N\c1ccccc1
InChIInChI=1S/C26H23N3O2/c1-3-28-22-13-9-8-12-20(22)21-16-18(14-15-23(21)28)17-24-25(30)29(4-2)26(31-24)27-19-10-6-5-7-11-19/h5-17H,3-4H2,1-2H3/b24-17+,27-26-
InChIKeyGZRCCUDQLHNDGY-UINIZAEWSA-N
XLogP5.72
TPSA46.83 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500409.49
LogP ≤ 55.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze (5E)-3-ethyl-5-[(9-ethylcarbazol-3-yl)methylidene]-2-phenylimino-1,3-oxazolidin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(5E)-3-ethyl-5-[(9-ethylcarbazol-3-yl)methylidene]-2-propylimino-1,3-oxazolidin-4-one
CID 59672435
4-[[(5E)-3-[(4-ethoxyphenyl)methyl]-5-[(9-ethylcarbazol-3-yl)methylidene]-4-oxo-1,3-oxazolidin-2-ylidene]amino]benzaldehyde
CID 88933371
3-ethyl-5-[(4-methoxyphenyl)methylidene]-2-phenylimino-1,3-oxazolidin-4-one
CID 76574452
ethyl 4-[[(5E)-3-[(4-ethoxyphenyl)methyl]-5-[(9-ethylcarbazol-3-yl)methylidene]-4-oxo-1,3-oxazolidin-2-ylidene]amino]benzoate
CID 58958964
(5E)-3-[(4-ethoxyphenyl)methyl]-5-[(9-ethylcarbazol-3-yl)methylidene]-1,3-oxazolidine-2,4-dione
CID 58785600
(2E)-2-[(9-ethylcarbazol-3-yl)methylidene]-1-benzofuran-3-one
CID 58621794
(5E)-3-ethyl-5-[(9-ethylcarbazol-3-yl)methylidene]-2-(2-phenylethylimino)-1,3-thiazolidin-4-one
CID 59760772
dimethyl 2-[[(5E)-3-ethyl-4-oxo-5-[[4-(N-phenylanilino)phenyl]methylidene]-1,3-oxazolidin-2-ylidene]amino]benzene-1,4-dicarboxylate;ethyl 4-[[(5E)-3-[(4-ethoxyphenyl)methyl]-5-[(9-ethylcarbazol-3-yl)methylidene]-4-oxo-1,3-oxazolidin-2-ylidene]amino]benzoate;ethyl 3-[[(5E)-3-[3-(4-ethoxyphenyl)propyl]-5-[(4-methoxyphenyl)methylidene]-4-oxo-1,3-oxazolidin-2-ylidene]amino]benzoate;ethyl 2-[[(5E)-5-[(9-ethylcarbazol-3-yl)methylidene]-4-oxo-3-(2-phenylethyl)-1,3-oxazolidin-2-ylidene]amino]benzoate;ethyl 2-[[(5E)-3-ethyl-4-oxo-5-[[4-(N-phenylanilino)phenyl]methylidene]-1,3-oxazolidin-2-ylidene]amino]benzoate;ethyl 2-[[(5E)-4-oxo-5-[[4-(N-phenylanilino)phenyl]methylidene]-3-(2-phenylethyl)-1,3-oxazolidin-2-ylidene]amino]benzoate
CID 159968264
1-(9-ethylcarbazol-3-yl)-N-(1,2,4-triazol-4-yl)methanimine
CID 781157
2-[[(5E)-3-[2-(4-methoxyphenyl)ethyl]-4-oxo-5-[(9-phenylcarbazol-3-yl)methylidene]-1,3-oxazolidin-2-ylidene]amino]benzaldehyde
CID 88914523
ethyl (5Z)-5-[(9-ethylcarbazol-3-yl)methylidene]-4-hydroxy-2-phenyliminothiophene-3-carboxylate
CID 135927064
2-[(9-ethylcarbazol-3-yl)methylidene]-1-phenylindol-3-one
CID 76840870

Frequently Asked Questions

What is the IUPAC name of (5E)-3-ethyl-5-[(9-ethylcarbazol-3-yl)methylidene]-2-phenylimino-1,3-oxazolidin-4-one?
The IUPAC name of (5E)-3-ethyl-5-[(9-ethylcarbazol-3-yl)methylidene]-2-phenylimino-1,3-oxazolidin-4-one (CID 58958967) is (5E)-3-ethyl-5-[(9-ethylcarbazol-3-yl)methylidene]-2-phenylimino-1,3-oxazolidin-4-one.
What is the SMILES notation for (5E)-3-ethyl-5-[(9-ethylcarbazol-3-yl)methylidene]-2-phenylimino-1,3-oxazolidin-4-one?
The canonical SMILES for (5E)-3-ethyl-5-[(9-ethylcarbazol-3-yl)methylidene]-2-phenylimino-1,3-oxazolidin-4-one is CCN1C(=O)/C(=C\c2ccc3c(c2)c2ccccc2n3CC)O/C1=N\c1ccccc1.
What is the InChIKey of (5E)-3-ethyl-5-[(9-ethylcarbazol-3-yl)methylidene]-2-phenylimino-1,3-oxazolidin-4-one?
The InChIKey is GZRCCUDQLHNDGY-UINIZAEWSA-N. The full InChI is InChI=1S/C26H23N3O2/c1-3-28-22-13-9-8-12-20(22)21-16-18(14-15-23(21)28)17-24-25(30)29(4-2)26(31-24)27-19-10-6-5-7-11-19/h5-17H,3-4H2,1-2H3/b24-17+,27-26-.
What are the key properties of (5E)-3-ethyl-5-[(9-ethylcarbazol-3-yl)methylidene]-2-phenylimino-1,3-oxazolidin-4-one?
(5E)-3-ethyl-5-[(9-ethylcarbazol-3-yl)methylidene]-2-phenylimino-1,3-oxazolidin-4-one has a molecular weight of 409.49 g/mol, XLogP of 5.72, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-3-ethyl-5-[(9-ethylcarbazol-3-yl)methylidene]-2-phenylimino-1,3-oxazolidin-4-one is sourced from PubChem (CID 58958967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).