1-(4-methoxyphenyl)-1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]ethanol

C18H18N2O3S — CID 46948343

IUPAC1-(4-methoxyphenyl)-1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]ethanol
SMILESCOc1ccc(C(C)(O)c2nc(-c3ccc(OC)nc3)cs2)cc1
InChIInChI=1S/C18H18N2O3S/c1-18(21,13-5-7-14(22-2)8-6-13)17-20-15(11-24-17)12-4-9-16(23-3)19-10-12/h4-11,21H,1-3H3
InChIKeyZEBGTVHBHKJVCI-UHFFFAOYSA-N
MW342.42 g/mol
LogP3.48
Rot. Bonds5

About 1-(4-methoxyphenyl)-1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]ethanol

1-(4-methoxyphenyl)-1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]ethanol (PubChem CID 46948343) has the molecular formula C18H18N2O3S and a molecular weight of 342.42 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]ethanol.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]ethanol
PubChem CID46948343
Molecular FormulaC18H18N2O3S
Molecular Weight342.42 g/mol
Exact Mass342.10
IUPAC Name1-(4-methoxyphenyl)-1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]ethanol
SMILESCOc1ccc(C(C)(O)c2nc(-c3ccc(OC)nc3)cs2)cc1
InChIInChI=1S/C18H18N2O3S/c1-18(21,13-5-7-14(22-2)8-6-13)17-20-15(11-24-17)12-4-9-16(23-3)19-10-12/h4-11,21H,1-3H3
InChIKeyZEBGTVHBHKJVCI-UHFFFAOYSA-N
XLogP3.48
TPSA64.47 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.42
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-(4-methoxyphenyl)-1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]ethanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]ethanol?
The IUPAC name of 1-(4-methoxyphenyl)-1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]ethanol (CID 46948343) is 1-(4-methoxyphenyl)-1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]ethanol.
What is the SMILES notation for 1-(4-methoxyphenyl)-1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]ethanol?
The canonical SMILES for 1-(4-methoxyphenyl)-1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]ethanol is COc1ccc(C(C)(O)c2nc(-c3ccc(OC)nc3)cs2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]ethanol?
The InChIKey is ZEBGTVHBHKJVCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3S/c1-18(21,13-5-7-14(22-2)8-6-13)17-20-15(11-24-17)12-4-9-16(23-3)19-10-12/h4-11,21H,1-3H3.
What are the key properties of 1-(4-methoxyphenyl)-1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]ethanol?
1-(4-methoxyphenyl)-1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]ethanol has a molecular weight of 342.42 g/mol, XLogP of 3.48, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]ethanol is sourced from PubChem (CID 46948343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).