2-(4-methoxyphenyl)-5-phenyl-1,3-thiazol-4-ol

C16H13NO2S — CID 14425906

IUPAC2-(4-methoxyphenyl)-5-phenyl-1,3-thiazol-4-ol
SMILESCOc1ccc(-c2nc(O)c(-c3ccccc3)s2)cc1
InChIInChI=1S/C16H13NO2S/c1-19-13-9-7-12(8-10-13)16-17-15(18)14(20-16)11-5-3-2-4-6-11/h2-10,18H,1H3
InChIKeyYQAKORGQQCUKEJ-UHFFFAOYSA-N
MW283.35 g/mol
LogP4.19
Rot. Bonds3

About 2-(4-methoxyphenyl)-5-phenyl-1,3-thiazol-4-ol

2-(4-methoxyphenyl)-5-phenyl-1,3-thiazol-4-ol (PubChem CID 14425906) has the molecular formula C16H13NO2S and a molecular weight of 283.35 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-5-phenyl-1,3-thiazol-4-ol.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-5-phenyl-1,3-thiazol-4-ol
PubChem CID14425906
Molecular FormulaC16H13NO2S
Molecular Weight283.35 g/mol
Exact Mass283.07
IUPAC Name2-(4-methoxyphenyl)-5-phenyl-1,3-thiazol-4-ol
SMILESCOc1ccc(-c2nc(O)c(-c3ccccc3)s2)cc1
InChIInChI=1S/C16H13NO2S/c1-19-13-9-7-12(8-10-13)16-17-15(18)14(20-16)11-5-3-2-4-6-11/h2-10,18H,1H3
InChIKeyYQAKORGQQCUKEJ-UHFFFAOYSA-N
XLogP4.19
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.35
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-5-phenyl-1,3-thiazol-4-ol?
The IUPAC name of 2-(4-methoxyphenyl)-5-phenyl-1,3-thiazol-4-ol (CID 14425906) is 2-(4-methoxyphenyl)-5-phenyl-1,3-thiazol-4-ol.
What is the SMILES notation for 2-(4-methoxyphenyl)-5-phenyl-1,3-thiazol-4-ol?
The canonical SMILES for 2-(4-methoxyphenyl)-5-phenyl-1,3-thiazol-4-ol is COc1ccc(-c2nc(O)c(-c3ccccc3)s2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-5-phenyl-1,3-thiazol-4-ol?
The InChIKey is YQAKORGQQCUKEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO2S/c1-19-13-9-7-12(8-10-13)16-17-15(18)14(20-16)11-5-3-2-4-6-11/h2-10,18H,1H3.
What are the key properties of 2-(4-methoxyphenyl)-5-phenyl-1,3-thiazol-4-ol?
2-(4-methoxyphenyl)-5-phenyl-1,3-thiazol-4-ol has a molecular weight of 283.35 g/mol, XLogP of 4.19, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-5-phenyl-1,3-thiazol-4-ol is sourced from PubChem (CID 14425906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).