[2-[2-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl]methanol

C16H14N2OS — CID 56702750

IUPAC[2-[2-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl]methanol
SMILESCc1nnc(-c2ccccc2-c2ccccc2CO)s1
InChIInChI=1S/C16H14N2OS/c1-11-17-18-16(20-11)15-9-5-4-8-14(15)13-7-3-2-6-12(13)10-19/h2-9,19H,10H2,1H3
InChIKeyHBUNAPIBFYJWBE-UHFFFAOYSA-N
MW282.37 g/mol
LogP3.67
Rot. Bonds3

About [2-[2-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl]methanol

[2-[2-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl]methanol (PubChem CID 56702750) has the molecular formula C16H14N2OS and a molecular weight of 282.37 g/mol. Its IUPAC name is [2-[2-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl]methanol.

Molecular Properties

Compound Name[2-[2-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl]methanol
PubChem CID56702750
Molecular FormulaC16H14N2OS
Molecular Weight282.37 g/mol
Exact Mass282.08
IUPAC Name[2-[2-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl]methanol
SMILESCc1nnc(-c2ccccc2-c2ccccc2CO)s1
InChIInChI=1S/C16H14N2OS/c1-11-17-18-16(20-11)15-9-5-4-8-14(15)13-7-3-2-6-12(13)10-19/h2-9,19H,10H2,1H3
InChIKeyHBUNAPIBFYJWBE-UHFFFAOYSA-N
XLogP3.67
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.37
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2,6-difluoro-5-(5-methyl-1,3,4-thiadiazol-2-yl)-3-pyridinyl]methanol
CID 67320433
[2-(5-methylthiophen-2-yl)phenyl]methanol
CID 164647346
[2-[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]phenyl]methanol
CID 56709300
[2-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl] carbamate
CID 174464729
[2-(5-methyl-1,3-oxazol-4-yl)phenyl]methanol
CID 105443456
2-(2-chloro-3-pyridinyl)-5-methyl-1,3,4-thiadiazole
CID 137347506
2,5-bis(2-methylphenyl)-1,3,4-thiadiazole
CID 139674338
[2-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methanol
CID 50850420
[2-[2-(methylaminomethyl)phenyl]phenyl]methanol
CID 70630718
2-(2-aminophenyl)-1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]ethanol
CID 123661945
ethyl 3-[4-[2-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl]triazole-4-carboxylate
CID 175293448
[2-(4,5-dimethylpyridazin-3-yl)phenyl]methanol
CID 163317973

Frequently Asked Questions

What is the IUPAC name of [2-[2-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl]methanol?
The IUPAC name of [2-[2-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl]methanol (CID 56702750) is [2-[2-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl]methanol.
What is the SMILES notation for [2-[2-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl]methanol?
The canonical SMILES for [2-[2-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl]methanol is Cc1nnc(-c2ccccc2-c2ccccc2CO)s1.
What is the InChIKey of [2-[2-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl]methanol?
The InChIKey is HBUNAPIBFYJWBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2OS/c1-11-17-18-16(20-11)15-9-5-4-8-14(15)13-7-3-2-6-12(13)10-19/h2-9,19H,10H2,1H3.
What are the key properties of [2-[2-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl]methanol?
[2-[2-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl]methanol has a molecular weight of 282.37 g/mol, XLogP of 3.67, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(5-methyl-1,3,4-thiadiazol-2-yl)phenyl]phenyl]methanol is sourced from PubChem (CID 56702750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).