2,3-bis(3-fluorophenyl)-5-phenyl-1H-tetrazole;hydrochloride

C19H15ClF2N4 — CID 173024183

IUPAC2,3-bis(3-fluorophenyl)-5-phenyl-1H-tetrazole;hydrochloride
SMILESCl.Fc1cccc(N2N=C(c3ccccc3)NN2c2cccc(F)c2)c1
InChIInChI=1S/C19H14F2N4.ClH/c20-15-8-4-10-17(12-15)24-22-19(14-6-2-1-3-7-14)23-25(24)18-11-5-9-16(21)13-18;/h1-13H,(H,22,23);1H
InChIKeyYRCDKHRMZGKCAE-UHFFFAOYSA-N
MW372.81 g/mol
LogP4.49
Rot. Bonds3

About 2,3-bis(3-fluorophenyl)-5-phenyl-1H-tetrazole;hydrochloride

2,3-bis(3-fluorophenyl)-5-phenyl-1H-tetrazole;hydrochloride (PubChem CID 173024183) has the molecular formula C19H15ClF2N4 and a molecular weight of 372.81 g/mol. Its IUPAC name is 2,3-bis(3-fluorophenyl)-5-phenyl-1H-tetrazole;hydrochloride.

Molecular Properties

Compound Name2,3-bis(3-fluorophenyl)-5-phenyl-1H-tetrazole;hydrochloride
PubChem CID173024183
Molecular FormulaC19H15ClF2N4
Molecular Weight372.81 g/mol
Exact Mass372.10
IUPAC Name2,3-bis(3-fluorophenyl)-5-phenyl-1H-tetrazole;hydrochloride
SMILESCl.Fc1cccc(N2N=C(c3ccccc3)NN2c2cccc(F)c2)c1
InChIInChI=1S/C19H14F2N4.ClH/c20-15-8-4-10-17(12-15)24-22-19(14-6-2-1-3-7-14)23-25(24)18-11-5-9-16(21)13-18;/h1-13H,(H,22,23);1H
InChIKeyYRCDKHRMZGKCAE-UHFFFAOYSA-N
XLogP4.49
TPSA30.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.81
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,3-bis(3-fluorophenyl)-5-phenyl-1H-tetrazole;hydrochloride?
The IUPAC name of 2,3-bis(3-fluorophenyl)-5-phenyl-1H-tetrazole;hydrochloride (CID 173024183) is 2,3-bis(3-fluorophenyl)-5-phenyl-1H-tetrazole;hydrochloride.
What is the SMILES notation for 2,3-bis(3-fluorophenyl)-5-phenyl-1H-tetrazole;hydrochloride?
The canonical SMILES for 2,3-bis(3-fluorophenyl)-5-phenyl-1H-tetrazole;hydrochloride is Cl.Fc1cccc(N2N=C(c3ccccc3)NN2c2cccc(F)c2)c1.
What is the InChIKey of 2,3-bis(3-fluorophenyl)-5-phenyl-1H-tetrazole;hydrochloride?
The InChIKey is YRCDKHRMZGKCAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F2N4.ClH/c20-15-8-4-10-17(12-15)24-22-19(14-6-2-1-3-7-14)23-25(24)18-11-5-9-16(21)13-18;/h1-13H,(H,22,23);1H.
What are the key properties of 2,3-bis(3-fluorophenyl)-5-phenyl-1H-tetrazole;hydrochloride?
2,3-bis(3-fluorophenyl)-5-phenyl-1H-tetrazole;hydrochloride has a molecular weight of 372.81 g/mol, XLogP of 4.49, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(3-fluorophenyl)-5-phenyl-1H-tetrazole;hydrochloride is sourced from PubChem (CID 173024183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).