3-[5-(5-methyl-1,2-oxazol-4-yl)-1,3-thiazol-2-yl]phenol

C13H10N2O2S — CID 102707160

IUPAC3-[5-(5-methyl-1,2-oxazol-4-yl)-1,3-thiazol-2-yl]phenol
SMILESCc1oncc1-c1cnc(-c2cccc(O)c2)s1
InChIInChI=1S/C13H10N2O2S/c1-8-11(6-15-17-8)12-7-14-13(18-12)9-3-2-4-10(16)5-9/h2-7,16H,1H3
InChIKeyBRDIOMWOBKZAHK-UHFFFAOYSA-N
MW258.30 g/mol
LogP3.48
Rot. Bonds2

About 3-[5-(5-methyl-1,2-oxazol-4-yl)-1,3-thiazol-2-yl]phenol

3-[5-(5-methyl-1,2-oxazol-4-yl)-1,3-thiazol-2-yl]phenol (PubChem CID 102707160) has the molecular formula C13H10N2O2S and a molecular weight of 258.30 g/mol. Its IUPAC name is 3-[5-(5-methyl-1,2-oxazol-4-yl)-1,3-thiazol-2-yl]phenol.

Molecular Properties

Compound Name3-[5-(5-methyl-1,2-oxazol-4-yl)-1,3-thiazol-2-yl]phenol
PubChem CID102707160
Molecular FormulaC13H10N2O2S
Molecular Weight258.30 g/mol
Exact Mass258.05
IUPAC Name3-[5-(5-methyl-1,2-oxazol-4-yl)-1,3-thiazol-2-yl]phenol
SMILESCc1oncc1-c1cnc(-c2cccc(O)c2)s1
InChIInChI=1S/C13H10N2O2S/c1-8-11(6-15-17-8)12-7-14-13(18-12)9-3-2-4-10(16)5-9/h2-7,16H,1H3
InChIKeyBRDIOMWOBKZAHK-UHFFFAOYSA-N
XLogP3.48
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[4-[5-(5-methyl-1,2-oxazol-4-yl)-1,3-thiazol-2-yl]phenyl]methanamine
CID 102707145
3-[5-(5-methyl-1,2-oxazol-4-yl)-1,2,4-oxadiazol-3-yl]phenol
CID 43120312
3-[5-(methylaminomethyl)-1,3-thiazol-2-yl]phenol
CID 61282920
3-[5-[2-(methylamino)ethyl]-1,3-thiazol-2-yl]phenol
CID 115091792
3-[5-(2-aminocyclopropyl)-1,3-thiazol-2-yl]phenol;hydrochloride
CID 66714329
2-(3-tert-butylphenyl)-5-phenyl-1,3-thiazole
CID 122594500
3-[4-(2-methylphenyl)-1,3-thiazol-2-yl]phenol
CID 28942300
3-(5-methyl-4-phenyl-1,3-thiazol-2-yl)phenol
CID 28942281
3-hydroxy-4-methyl-5-(2-phenyl-1,3-thiazol-5-yl)pyridine-2-carboxylic acid
CID 162731592
1-[2-(3-methylphenyl)-1,3-thiazol-5-yl]ethanol
CID 62651210
2-naphthalen-2-yl-5-phenyl-1,3-thiazole
CID 90384723
2-(4-methylphenyl)-5-naphthalen-1-yl-1,3-thiazole
CID 23244777

Frequently Asked Questions

What is the IUPAC name of 3-[5-(5-methyl-1,2-oxazol-4-yl)-1,3-thiazol-2-yl]phenol?
The IUPAC name of 3-[5-(5-methyl-1,2-oxazol-4-yl)-1,3-thiazol-2-yl]phenol (CID 102707160) is 3-[5-(5-methyl-1,2-oxazol-4-yl)-1,3-thiazol-2-yl]phenol.
What is the SMILES notation for 3-[5-(5-methyl-1,2-oxazol-4-yl)-1,3-thiazol-2-yl]phenol?
The canonical SMILES for 3-[5-(5-methyl-1,2-oxazol-4-yl)-1,3-thiazol-2-yl]phenol is Cc1oncc1-c1cnc(-c2cccc(O)c2)s1.
What is the InChIKey of 3-[5-(5-methyl-1,2-oxazol-4-yl)-1,3-thiazol-2-yl]phenol?
The InChIKey is BRDIOMWOBKZAHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2O2S/c1-8-11(6-15-17-8)12-7-14-13(18-12)9-3-2-4-10(16)5-9/h2-7,16H,1H3.
What are the key properties of 3-[5-(5-methyl-1,2-oxazol-4-yl)-1,3-thiazol-2-yl]phenol?
3-[5-(5-methyl-1,2-oxazol-4-yl)-1,3-thiazol-2-yl]phenol has a molecular weight of 258.30 g/mol, XLogP of 3.48, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(5-methyl-1,2-oxazol-4-yl)-1,3-thiazol-2-yl]phenol is sourced from PubChem (CID 102707160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).