(1-benzyltriazol-4-yl)-diphenylmethanol

C22H19N3O — CID 123148600

IUPAC(1-benzyltriazol-4-yl)-diphenylmethanol
SMILESOC(c1ccccc1)(c1ccccc1)c1cn(Cc2ccccc2)nn1
InChIInChI=1S/C22H19N3O/c26-22(19-12-6-2-7-13-19,20-14-8-3-9-15-20)21-17-25(24-23-21)16-18-10-4-1-5-11-18/h1-15,17,26H,16H2
InChIKeyJTJMWSWTNVRNMS-UHFFFAOYSA-N
MW341.41 g/mol
LogP3.61
Rot. Bonds5

About (1-benzyltriazol-4-yl)-diphenylmethanol

(1-benzyltriazol-4-yl)-diphenylmethanol (PubChem CID 123148600) has the molecular formula C22H19N3O and a molecular weight of 341.41 g/mol. Its IUPAC name is (1-benzyltriazol-4-yl)-diphenylmethanol.

Molecular Properties

Compound Name(1-benzyltriazol-4-yl)-diphenylmethanol
PubChem CID123148600
Molecular FormulaC22H19N3O
Molecular Weight341.41 g/mol
Exact Mass341.15
IUPAC Name(1-benzyltriazol-4-yl)-diphenylmethanol
SMILESOC(c1ccccc1)(c1ccccc1)c1cn(Cc2ccccc2)nn1
InChIInChI=1S/C22H19N3O/c26-22(19-12-6-2-7-13-19,20-14-8-3-9-15-20)21-17-25(24-23-21)16-18-10-4-1-5-11-18/h1-15,17,26H,16H2
InChIKeyJTJMWSWTNVRNMS-UHFFFAOYSA-N
XLogP3.61
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-Benzylpiperidin-1-yl)-[4-[hydroxy(diphenyl)methyl]triazol-1-yl]methanone
CID 53364459
2-[(4-Benzyltriazol-1-yl)methyl]phenol
CID 11437030
1-(1-Benzyltriazol-4-yl)cyclohexan-1-ol
CID 651657
2-chloro-N-[4-[4-[hydroxy(diphenyl)methyl]triazol-1-yl]phenyl]acetamide
CID 134136503
N-[4-[4-[hydroxy(diphenyl)methyl]triazol-1-yl]phenyl]acetamide
CID 134141156
2-[1-[(4-Propan-2-ylphenyl)methyl]triazol-4-yl]phenol
CID 122179795
2-[(4-Phenyltriazol-1-yl)methyl]phenol
CID 162354251
1-Phenyl-2-[4-[(4-phenylpiperazin-1-yl)methyl]triazol-1-yl]ethanol
CID 46863267
2-[4-[[Cyclohexylmethyl(methyl)amino]methyl]triazol-1-yl]-1-phenylethanol
CID 46863378
2-[4-[[Methyl(3-methylbutyl)amino]methyl]triazol-1-yl]-1-phenylethanol
CID 46863379
4-[4-[1-(3-Phenylpropyl)triazol-4-yl]phenyl]phenol
CID 51355701
1-(1-Octyltriazol-4-yl)-2-phenyl-ethanol
CID 56673743

Frequently Asked Questions

What is the IUPAC name of (1-benzyltriazol-4-yl)-diphenylmethanol?
The IUPAC name of (1-benzyltriazol-4-yl)-diphenylmethanol (CID 123148600) is (1-benzyltriazol-4-yl)-diphenylmethanol.
What is the SMILES notation for (1-benzyltriazol-4-yl)-diphenylmethanol?
The canonical SMILES for (1-benzyltriazol-4-yl)-diphenylmethanol is OC(c1ccccc1)(c1ccccc1)c1cn(Cc2ccccc2)nn1.
What is the InChIKey of (1-benzyltriazol-4-yl)-diphenylmethanol?
The InChIKey is JTJMWSWTNVRNMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O/c26-22(19-12-6-2-7-13-19,20-14-8-3-9-15-20)21-17-25(24-23-21)16-18-10-4-1-5-11-18/h1-15,17,26H,16H2.
What are the key properties of (1-benzyltriazol-4-yl)-diphenylmethanol?
(1-benzyltriazol-4-yl)-diphenylmethanol has a molecular weight of 341.41 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-benzyltriazol-4-yl)-diphenylmethanol is sourced from PubChem (CID 123148600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).