[5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(3-fluorophenyl)-(3-methylimidazol-4-yl)methanol

C26H18ClFN6O — CID 23388988

IUPAC[5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(3-fluorophenyl)-(3-methylimidazol-4-yl)methanol
SMILESCn1cncc1C(O)(c1cccc(F)c1)c1ccc2c(c1)c(-c1cccc(Cl)c1)cc1nnnn12
InChIInChI=1S/C26H18ClFN6O/c1-33-15-29-14-24(33)26(35,17-5-3-7-20(28)11-17)18-8-9-23-22(12-18)21(13-25-30-31-32-34(23)25)16-4-2-6-19(27)10-16/h2-15,35H,1H3
InChIKeyILPCVAGCEGRBLZ-UHFFFAOYSA-N
MW484.92 g/mol
LogP4.75
Rot. Bonds4

About [5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(3-fluorophenyl)-(3-methylimidazol-4-yl)methanol

[5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(3-fluorophenyl)-(3-methylimidazol-4-yl)methanol (PubChem CID 23388988) has the molecular formula C26H18ClFN6O and a molecular weight of 484.92 g/mol. Its IUPAC name is [5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(3-fluorophenyl)-(3-methylimidazol-4-yl)methanol.

Molecular Properties

Compound Name[5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(3-fluorophenyl)-(3-methylimidazol-4-yl)methanol
PubChem CID23388988
Molecular FormulaC26H18ClFN6O
Molecular Weight484.92 g/mol
Exact Mass484.12
IUPAC Name[5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(3-fluorophenyl)-(3-methylimidazol-4-yl)methanol
SMILESCn1cncc1C(O)(c1cccc(F)c1)c1ccc2c(c1)c(-c1cccc(Cl)c1)cc1nnnn12
InChIInChI=1S/C26H18ClFN6O/c1-33-15-29-14-24(33)26(35,17-5-3-7-20(28)11-17)18-8-9-23-22(12-18)21(13-25-30-31-32-34(23)25)16-4-2-6-19(27)10-16/h2-15,35H,1H3
InChIKeyILPCVAGCEGRBLZ-UHFFFAOYSA-N
XLogP4.75
TPSA81.13 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500484.92
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze [5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(3-fluorophenyl)-(3-methylimidazol-4-yl)methanol with MolForge

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Related Compounds

(2,4-Dichloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-(2-methyl-4-pyridinyl)methanol
CID 74222221
(2,4-Dichloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-quinolin-4-ylmethanol
CID 117869728
[5-(3-Chlorophenyl)tetrazolo[1,5-a]quinazolin-7-yl]-(5-chlorothiophen-2-yl)-(3-methylimidazol-4-yl)methanol
CID 9892477
4-[[5-[[5-(3-Chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-hydroxymethyl]imidazol-1-yl]methyl]benzonitrile
CID 16724146
(3-Benzyl-2,4-dichloroquinolin-6-yl)(4-chlorophenyl)(1-methyl-1H-imidazol-5-yl)methanol
CID 74221196
(2,4-Dichloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-pyridin-3-ylmethanol
CID 74222048
(4-Chlorophenyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-(2,3-dimethylimidazol-4-yl)methanol
CID 74222808
(2,4-Dichloro-3-phenylquinolin-6-yl)(1-methyl-1H-imidazol-5-yl)(pyridin-4-yl)methanol
CID 74222810
[2-Chloro-4-(dimethylamino)-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol
CID 86716113
[4-Chloro-2-(diethylamino)-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol
CID 86716129
(4-Chlorophenyl)(1-methyl-1H-imidazol-5-yl)(3-phenyl-2,4-bis(trifluoromethyl)quinolin-6-yl)methanol
CID 86716130
(4-Chlorophenyl)(2,4-dichloro-3-phenylquinolin-6-yl)(1-methyl-1H-imidazol-5-yl)methanol
CID 90100965

Frequently Asked Questions

What is the IUPAC name of [5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(3-fluorophenyl)-(3-methylimidazol-4-yl)methanol?
The IUPAC name of [5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(3-fluorophenyl)-(3-methylimidazol-4-yl)methanol (CID 23388988) is [5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(3-fluorophenyl)-(3-methylimidazol-4-yl)methanol.
What is the SMILES notation for [5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(3-fluorophenyl)-(3-methylimidazol-4-yl)methanol?
The canonical SMILES for [5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(3-fluorophenyl)-(3-methylimidazol-4-yl)methanol is Cn1cncc1C(O)(c1cccc(F)c1)c1ccc2c(c1)c(-c1cccc(Cl)c1)cc1nnnn12.
What is the InChIKey of [5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(3-fluorophenyl)-(3-methylimidazol-4-yl)methanol?
The InChIKey is ILPCVAGCEGRBLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18ClFN6O/c1-33-15-29-14-24(33)26(35,17-5-3-7-20(28)11-17)18-8-9-23-22(12-18)21(13-25-30-31-32-34(23)25)16-4-2-6-19(27)10-16/h2-15,35H,1H3.
What are the key properties of [5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(3-fluorophenyl)-(3-methylimidazol-4-yl)methanol?
[5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(3-fluorophenyl)-(3-methylimidazol-4-yl)methanol has a molecular weight of 484.92 g/mol, XLogP of 4.75, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(3-chlorophenyl)tetrazolo[1,5-a]quinolin-7-yl]-(3-fluorophenyl)-(3-methylimidazol-4-yl)methanol is sourced from PubChem (CID 23388988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).