5-methyl-4-phenyl-3-[(E)-3-phenylprop-2-enyl]-1,3-thiazol-2-one

C19H17NOS — CID 51132299

IUPAC5-methyl-4-phenyl-3-[(E)-3-phenylprop-2-enyl]-1,3-thiazol-2-one
SMILESCc1sc(=O)n(C/C=C/c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C19H17NOS/c1-15-18(17-12-6-3-7-13-17)20(19(21)22-15)14-8-11-16-9-4-2-5-10-16/h2-13H,14H2,1H3/b11-8+
InChIKeySHTISFDBJDWQJR-DHZHZOJOSA-N
MW307.42 g/mol
LogP4.60
Rot. Bonds4

About 5-methyl-4-phenyl-3-[(E)-3-phenylprop-2-enyl]-1,3-thiazol-2-one

5-methyl-4-phenyl-3-[(E)-3-phenylprop-2-enyl]-1,3-thiazol-2-one (PubChem CID 51132299) has the molecular formula C19H17NOS and a molecular weight of 307.42 g/mol. Its IUPAC name is 5-methyl-4-phenyl-3-[(E)-3-phenylprop-2-enyl]-1,3-thiazol-2-one.

Molecular Properties

Compound Name5-methyl-4-phenyl-3-[(E)-3-phenylprop-2-enyl]-1,3-thiazol-2-one
PubChem CID51132299
Molecular FormulaC19H17NOS
Molecular Weight307.42 g/mol
Exact Mass307.10
IUPAC Name5-methyl-4-phenyl-3-[(E)-3-phenylprop-2-enyl]-1,3-thiazol-2-one
SMILESCc1sc(=O)n(C/C=C/c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C19H17NOS/c1-15-18(17-12-6-3-7-13-17)20(19(21)22-15)14-8-11-16-9-4-2-5-10-16/h2-13H,14H2,1H3/b11-8+
InChIKeySHTISFDBJDWQJR-DHZHZOJOSA-N
XLogP4.60
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.42
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-methyl-4-phenyl-3-[(E)-3-phenylprop-2-enyl]-1,3-thiazol-2-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

1-(3-phenylprop-2-enyl)-3,5-bis(prop-2-enyl)-1,3,5-triazinane-2,4,6-trione
CID 175517737
3-[(E)-3-phenylprop-2-enyl]quinazolin-4-one
CID 7772208
3-[(4-aminophenyl)methyl]-5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-one
CID 92936579
1-[(E)-3-phenylprop-2-enyl]pyridin-4-one
CID 116622263
3-methyl-5-phenyl-1-[(E)-3-phenylprop-2-enyl]-1,2,4-triazole
CID 52878167
6-ethyl-3-[(E)-3-phenylprop-2-enyl]thieno[2,3-d]pyrimidin-4-one
CID 18100074
[1-[(E)-3-phenylprop-2-enyl]indol-2-yl]methanol
CID 10801507
4-[4-(4-chlorophenyl)-5-methyl-2-oxo-1,3-thiazol-3-yl]butanoic acid
CID 43286990
2-(4-chlorophenyl)-1-[(E)-3-phenylprop-2-enyl]benzimidazole
CID 17001023
5-methyl-2-[(E)-3-phenylprop-2-enyl]pyrazole-3-carboxylic acid
CID 82293348
2-tert-butyl-1-[(E)-3-phenylprop-2-enyl]benzimidazole
CID 17000384
[(1E)-5-phenylpenta-1,4-dienyl]benzene
CID 91021368

Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-phenyl-3-[(E)-3-phenylprop-2-enyl]-1,3-thiazol-2-one?
The IUPAC name of 5-methyl-4-phenyl-3-[(E)-3-phenylprop-2-enyl]-1,3-thiazol-2-one (CID 51132299) is 5-methyl-4-phenyl-3-[(E)-3-phenylprop-2-enyl]-1,3-thiazol-2-one.
What is the SMILES notation for 5-methyl-4-phenyl-3-[(E)-3-phenylprop-2-enyl]-1,3-thiazol-2-one?
The canonical SMILES for 5-methyl-4-phenyl-3-[(E)-3-phenylprop-2-enyl]-1,3-thiazol-2-one is Cc1sc(=O)n(C/C=C/c2ccccc2)c1-c1ccccc1.
What is the InChIKey of 5-methyl-4-phenyl-3-[(E)-3-phenylprop-2-enyl]-1,3-thiazol-2-one?
The InChIKey is SHTISFDBJDWQJR-DHZHZOJOSA-N. The full InChI is InChI=1S/C19H17NOS/c1-15-18(17-12-6-3-7-13-17)20(19(21)22-15)14-8-11-16-9-4-2-5-10-16/h2-13H,14H2,1H3/b11-8+.
What are the key properties of 5-methyl-4-phenyl-3-[(E)-3-phenylprop-2-enyl]-1,3-thiazol-2-one?
5-methyl-4-phenyl-3-[(E)-3-phenylprop-2-enyl]-1,3-thiazol-2-one has a molecular weight of 307.42 g/mol, XLogP of 4.60, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4-phenyl-3-[(E)-3-phenylprop-2-enyl]-1,3-thiazol-2-one is sourced from PubChem (CID 51132299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).