4-(2-methyl-5H-1,3-thiazol-5-id-4-yl)benzene-1,3-diol;yttrium

C10H8NO2SY- — CID 159824116

IUPAC4-(2-methyl-5H-1,3-thiazol-5-id-4-yl)benzene-1,3-diol;yttrium
SMILESCc1nc(-c2ccc(O)cc2O)[c-]s1.[Y]
InChIInChI=1S/C10H8NO2S.Y/c1-6-11-9(5-14-6)8-3-2-7(12)4-10(8)13;/h2-4,12-13H,1H3;/q-1;
InChIKeyUVICKIYEPVSXEP-UHFFFAOYSA-N
MW295.15 g/mol
LogP2.33
Rot. Bonds1

About 4-(2-methyl-5H-1,3-thiazol-5-id-4-yl)benzene-1,3-diol;yttrium

4-(2-methyl-5H-1,3-thiazol-5-id-4-yl)benzene-1,3-diol;yttrium (PubChem CID 159824116) has the molecular formula C10H8NO2SY- and a molecular weight of 295.15 g/mol. Its IUPAC name is 4-(2-methyl-5H-1,3-thiazol-5-id-4-yl)benzene-1,3-diol;yttrium.

Molecular Properties

Compound Name4-(2-methyl-5H-1,3-thiazol-5-id-4-yl)benzene-1,3-diol;yttrium
PubChem CID159824116
Molecular FormulaC10H8NO2SY-
Molecular Weight295.15 g/mol
Exact Mass294.93
IUPAC Name4-(2-methyl-5H-1,3-thiazol-5-id-4-yl)benzene-1,3-diol;yttrium
SMILESCc1nc(-c2ccc(O)cc2O)[c-]s1.[Y]
InChIInChI=1S/C10H8NO2S.Y/c1-6-11-9(5-14-6)8-3-2-7(12)4-10(8)13;/h2-4,12-13H,1H3;/q-1;
InChIKeyUVICKIYEPVSXEP-UHFFFAOYSA-N
XLogP2.33
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.15
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

4-(5-fluoro-1,3-benzothiazol-2-yl)-3-methylphenol
CID 136750939
3-methyl-4-(5-methyl-1,3-benzothiazol-2-yl)phenol
CID 136750938
4-[3-(2,4-dihydroxyphenyl)-5-methylphenyl]benzene-1,3-diol
CID 137451666
4-(5,6-dimethyl-1H-benzimidazol-2-yl)benzene-1,3-diol
CID 136903792
4-(6-methylimidazo[1,2-a]pyrazin-5-yl)benzene-1,3-diol
CID 137179897
4-(3-amino-1,2-oxazol-5-yl)benzene-1,3-diol
CID 137015300
4-(5-fluoro-2-methyl-1-benzofuran-7-yl)benzene-1,3-diol
CID 143318510
4-[4-(2,4-dimethylphenyl)-6-(2-hydroxyphenyl)-1,3,5-triazin-2-yl]benzene-1,3-diol
CID 154233964
4-[5-(aminomethyl)-4-methyl-1,3-thiazol-2-yl]-3-fluorophenol
CID 136889727
4-[5-(2-methylanilino)-1,3,4-thiadiazol-2-yl]benzene-1,3-diol
CID 136747579
4-(4-hydroxy-2,3,6-trimethylphenyl)benzene-1,3-diol
CID 101299618
4-(6-chloro-1H-benzimidazol-2-yl)benzene-1,3-diol
CID 136903703

Frequently Asked Questions

What is the IUPAC name of 4-(2-methyl-5H-1,3-thiazol-5-id-4-yl)benzene-1,3-diol;yttrium?
The IUPAC name of 4-(2-methyl-5H-1,3-thiazol-5-id-4-yl)benzene-1,3-diol;yttrium (CID 159824116) is 4-(2-methyl-5H-1,3-thiazol-5-id-4-yl)benzene-1,3-diol;yttrium.
What is the SMILES notation for 4-(2-methyl-5H-1,3-thiazol-5-id-4-yl)benzene-1,3-diol;yttrium?
The canonical SMILES for 4-(2-methyl-5H-1,3-thiazol-5-id-4-yl)benzene-1,3-diol;yttrium is Cc1nc(-c2ccc(O)cc2O)[c-]s1.[Y].
What is the InChIKey of 4-(2-methyl-5H-1,3-thiazol-5-id-4-yl)benzene-1,3-diol;yttrium?
The InChIKey is UVICKIYEPVSXEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8NO2S.Y/c1-6-11-9(5-14-6)8-3-2-7(12)4-10(8)13;/h2-4,12-13H,1H3;/q-1;.
What are the key properties of 4-(2-methyl-5H-1,3-thiazol-5-id-4-yl)benzene-1,3-diol;yttrium?
4-(2-methyl-5H-1,3-thiazol-5-id-4-yl)benzene-1,3-diol;yttrium has a molecular weight of 295.15 g/mol, XLogP of 2.33, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methyl-5H-1,3-thiazol-5-id-4-yl)benzene-1,3-diol;yttrium is sourced from PubChem (CID 159824116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).