(4-methoxyphenyl)-(4-thiophen-2-yl-1,3-thiazol-2-yl)methanol

C15H13NO2S2 — CID 46943076

IUPAC(4-methoxyphenyl)-(4-thiophen-2-yl-1,3-thiazol-2-yl)methanol
SMILESCOc1ccc(C(O)c2nc(-c3cccs3)cs2)cc1
InChIInChI=1S/C15H13NO2S2/c1-18-11-6-4-10(5-7-11)14(17)15-16-12(9-20-15)13-3-2-8-19-13/h2-9,14,17H,1H3
InChIKeyXNDYEOSWDDNSLI-UHFFFAOYSA-N
MW303.41 g/mol
LogP3.96
Rot. Bonds4

About (4-methoxyphenyl)-(4-thiophen-2-yl-1,3-thiazol-2-yl)methanol

(4-methoxyphenyl)-(4-thiophen-2-yl-1,3-thiazol-2-yl)methanol (PubChem CID 46943076) has the molecular formula C15H13NO2S2 and a molecular weight of 303.41 g/mol. Its IUPAC name is (4-methoxyphenyl)-(4-thiophen-2-yl-1,3-thiazol-2-yl)methanol.

Molecular Properties

Compound Name(4-methoxyphenyl)-(4-thiophen-2-yl-1,3-thiazol-2-yl)methanol
PubChem CID46943076
Molecular FormulaC15H13NO2S2
Molecular Weight303.41 g/mol
Exact Mass303.04
IUPAC Name(4-methoxyphenyl)-(4-thiophen-2-yl-1,3-thiazol-2-yl)methanol
SMILESCOc1ccc(C(O)c2nc(-c3cccs3)cs2)cc1
InChIInChI=1S/C15H13NO2S2/c1-18-11-6-4-10(5-7-11)14(17)15-16-12(9-20-15)13-3-2-8-19-13/h2-9,14,17H,1H3
InChIKeyXNDYEOSWDDNSLI-UHFFFAOYSA-N
XLogP3.96
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(4-(4-Methoxyphenyl)thiazol-2-yl)phenol
CID 829532
4-(2,4-Dimethoxyphenyl)-2-thiophen-2-yl-1,3-thiazole
CID 2468633
4-[4-(4-Methoxy-phenyl)-thiazol-2-yl]-5-methylsulfanyl-thiophene-2-carboxamidine
CID 18537037
Benzo[D]thiazol-2-YL(4-methoxyphenyl)methanol
CID 647548
2-{[4-(4-Methoxyphenyl)-1,3-thiazol-2-yl]methyl}-1,3-thiazol-4-ol
CID 1482058
4-(3,4-Dimethoxyphenyl)-2-thiophen-2-ylthiazole
CID 2507089
(4-Methoxyphenyl)-[4-(2-naphthyl)thiazol-2-yl]methanol
CID 46942760
[4-(4-Fluoro-2-methoxyphenyl)-1,3-thiazol-2-yl]-(4-methoxyphenyl)methanol
CID 49790936
1-[4-(4-Methoxyphenyl)-1,3-thiazol-2-yl]-1-phenylethanol
CID 49792786
(4-Fluorophenyl)-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]methanol
CID 49795508
4-(2,5-Dimethoxyphenyl)-2-thiophen-2-yl-1,3-thiazole
CID 8750809
(3,4-Difluorophenyl)-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]methanol
CID 46942776

Frequently Asked Questions

What is the IUPAC name of (4-methoxyphenyl)-(4-thiophen-2-yl-1,3-thiazol-2-yl)methanol?
The IUPAC name of (4-methoxyphenyl)-(4-thiophen-2-yl-1,3-thiazol-2-yl)methanol (CID 46943076) is (4-methoxyphenyl)-(4-thiophen-2-yl-1,3-thiazol-2-yl)methanol.
What is the SMILES notation for (4-methoxyphenyl)-(4-thiophen-2-yl-1,3-thiazol-2-yl)methanol?
The canonical SMILES for (4-methoxyphenyl)-(4-thiophen-2-yl-1,3-thiazol-2-yl)methanol is COc1ccc(C(O)c2nc(-c3cccs3)cs2)cc1.
What is the InChIKey of (4-methoxyphenyl)-(4-thiophen-2-yl-1,3-thiazol-2-yl)methanol?
The InChIKey is XNDYEOSWDDNSLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO2S2/c1-18-11-6-4-10(5-7-11)14(17)15-16-12(9-20-15)13-3-2-8-19-13/h2-9,14,17H,1H3.
What are the key properties of (4-methoxyphenyl)-(4-thiophen-2-yl-1,3-thiazol-2-yl)methanol?
(4-methoxyphenyl)-(4-thiophen-2-yl-1,3-thiazol-2-yl)methanol has a molecular weight of 303.41 g/mol, XLogP of 3.96, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxyphenyl)-(4-thiophen-2-yl-1,3-thiazol-2-yl)methanol is sourced from PubChem (CID 46943076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).