4-[(E)-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]phenol

C17H13NOS — CID 135409428

IUPAC4-[(E)-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]phenol
SMILESOc1ccc(/C=C/c2nc(-c3ccccc3)cs2)cc1
InChIInChI=1S/C17H13NOS/c19-15-9-6-13(7-10-15)8-11-17-18-16(12-20-17)14-4-2-1-3-5-14/h1-12,19H/b11-8+
InChIKeyOWGKNPAOKVVDOK-DHZHZOJOSA-N
MW279.36 g/mol
LogP4.69
Rot. Bonds3

About 4-[(E)-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]phenol

4-[(E)-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]phenol (PubChem CID 135409428) has the molecular formula C17H13NOS and a molecular weight of 279.36 g/mol. Its IUPAC name is 4-[(E)-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]phenol.

Molecular Properties

Compound Name4-[(E)-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]phenol
PubChem CID135409428
Molecular FormulaC17H13NOS
Molecular Weight279.36 g/mol
Exact Mass279.07
IUPAC Name4-[(E)-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]phenol
SMILESOc1ccc(/C=C/c2nc(-c3ccccc3)cs2)cc1
InChIInChI=1S/C17H13NOS/c19-15-9-6-13(7-10-15)8-11-17-18-16(12-20-17)14-4-2-1-3-5-14/h1-12,19H/b11-8+
InChIKeyOWGKNPAOKVVDOK-DHZHZOJOSA-N
XLogP4.69
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.36
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(E)-2-(4-tert-butyl-1,3-thiazol-2-yl)ethenyl]phenol;4-[(E)-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]ethenyl]phenol;4-[(E)-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]phenol
CID 158279125
4-(4-fluorophenyl)-2-[(E)-2-(4-fluorophenyl)ethenyl]-1,3-thiazole
CID 162721186
3-[(E)-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]ethenyl]phenol
CID 15477392
4-[2-(4-phenylphenyl)ethenyl]phenol
CID 73178657
4-phenyl-1,3-thiazole-2-carbaldehyde
CID 3538814
4-[(E)-[(4-phenyl-1,3-thiazol-2-yl)hydrazinylidene]methyl]phenol
CID 135501477
4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]phenol
CID 52942315
4-(2-phenylethenyl)phenol
CID 157400568
2-[2-(1,3-diphenylpyrazol-4-yl)ethenyl]-4-phenyl-1,3-thiazole
CID 3250858
1-(4-phenyl-1,3-thiazol-2-yl)prop-1-en-2-amine
CID 70042347
4-[(E)-2-(3-phenyl-1H-pyrazol-5-yl)ethenyl]phenol
CID 135991591
2-[(E)-2-(4-tert-butylphenyl)ethenyl]-4-(4-fluorophenyl)-1,3-thiazole
CID 162721182

Frequently Asked Questions

What is the IUPAC name of 4-[(E)-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]phenol?
The IUPAC name of 4-[(E)-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]phenol (CID 135409428) is 4-[(E)-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]phenol.
What is the SMILES notation for 4-[(E)-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]phenol?
The canonical SMILES for 4-[(E)-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]phenol is Oc1ccc(/C=C/c2nc(-c3ccccc3)cs2)cc1.
What is the InChIKey of 4-[(E)-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]phenol?
The InChIKey is OWGKNPAOKVVDOK-DHZHZOJOSA-N. The full InChI is InChI=1S/C17H13NOS/c19-15-9-6-13(7-10-15)8-11-17-18-16(12-20-17)14-4-2-1-3-5-14/h1-12,19H/b11-8+.
What are the key properties of 4-[(E)-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]phenol?
4-[(E)-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]phenol has a molecular weight of 279.36 g/mol, XLogP of 4.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]phenol is sourced from PubChem (CID 135409428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).