1-[(3-chlorophenyl)methyl]-3-phenylpyrazolo[4,5-c]quinoline

C23H16ClN3 — CID 20852388

IUPAC1-[(3-chlorophenyl)methyl]-3-phenylpyrazolo[4,5-c]quinoline
SMILESClc1cccc(Cn2nc(-c3ccccc3)c3cnc4ccccc4c32)c1
InChIInChI=1S/C23H16ClN3/c24-18-10-6-7-16(13-18)15-27-23-19-11-4-5-12-21(19)25-14-20(23)22(26-27)17-8-2-1-3-9-17/h1-14H,15H2
InChIKeyOLTKBUDHHQAOEP-UHFFFAOYSA-N
MW369.86 g/mol
LogP5.95
Rot. Bonds3

About 1-[(3-chlorophenyl)methyl]-3-phenylpyrazolo[4,5-c]quinoline

1-[(3-chlorophenyl)methyl]-3-phenylpyrazolo[4,5-c]quinoline (PubChem CID 20852388) has the molecular formula C23H16ClN3 and a molecular weight of 369.86 g/mol. Its IUPAC name is 1-[(3-chlorophenyl)methyl]-3-phenylpyrazolo[4,5-c]quinoline.

Molecular Properties

Compound Name1-[(3-chlorophenyl)methyl]-3-phenylpyrazolo[4,5-c]quinoline
PubChem CID20852388
Molecular FormulaC23H16ClN3
Molecular Weight369.86 g/mol
Exact Mass369.10
IUPAC Name1-[(3-chlorophenyl)methyl]-3-phenylpyrazolo[4,5-c]quinoline
SMILESClc1cccc(Cn2nc(-c3ccccc3)c3cnc4ccccc4c32)c1
InChIInChI=1S/C23H16ClN3/c24-18-10-6-7-16(13-18)15-27-23-19-11-4-5-12-21(19)25-14-20(23)22(26-27)17-8-2-1-3-9-17/h1-14H,15H2
InChIKeyOLTKBUDHHQAOEP-UHFFFAOYSA-N
XLogP5.95
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.86
LogP ≤ 55.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-[(3-chlorophenyl)methyl]-3-phenylpyrazolo[4,5-c]quinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-chlorophenyl)-3-phenylpyrazolo[4,5-c]quinoline
CID 20852398
1-(4-chlorophenyl)-8-ethyl-3-phenylpyrazolo[4,3-c]quinoline
CID 20852477
2-[(3-chlorophenyl)methyl]-5-phenyltetrazole
CID 7278082
N-(4-methylphenyl)-2-(3-phenylpyrazolo[4,5-c]quinolin-1-yl)acetamide
CID 20952229
2-[1-[(3-chlorophenyl)methyl]indazol-3-yl]oxyacetic acid
CID 23173494
3-(3-chlorophenyl)-2-[(4-chlorophenyl)methyl]-7-(trifluoromethyl)indazole
CID 68816519
3-(4-chlorophenyl)-8-fluoro-1-phenylpyrazolo[4,3-c]quinoline
CID 20852861
3-(3-chlorophenyl)-2-[(3-methoxyphenyl)methyl]-7-(trifluoromethyl)indazole
CID 67021143
N-[[2-[(3-chlorophenyl)methyl]-5-phenyltriazol-4-yl]methyl]-1-phenylmethanamine
CID 124895280
8-bromo-1,3-diphenylpyrazolo[4,3-c]quinoline
CID 20852418
2-(8-ethyl-3-phenylpyrazolo[4,3-c]quinolin-1-yl)-N-phenylacetamide
CID 20952211
1-[(3-chlorophenyl)methylsulfanyl]-4-phenylphthalazine
CID 6992145

Frequently Asked Questions

What is the IUPAC name of 1-[(3-chlorophenyl)methyl]-3-phenylpyrazolo[4,5-c]quinoline?
The IUPAC name of 1-[(3-chlorophenyl)methyl]-3-phenylpyrazolo[4,5-c]quinoline (CID 20852388) is 1-[(3-chlorophenyl)methyl]-3-phenylpyrazolo[4,5-c]quinoline.
What is the SMILES notation for 1-[(3-chlorophenyl)methyl]-3-phenylpyrazolo[4,5-c]quinoline?
The canonical SMILES for 1-[(3-chlorophenyl)methyl]-3-phenylpyrazolo[4,5-c]quinoline is Clc1cccc(Cn2nc(-c3ccccc3)c3cnc4ccccc4c32)c1.
What is the InChIKey of 1-[(3-chlorophenyl)methyl]-3-phenylpyrazolo[4,5-c]quinoline?
The InChIKey is OLTKBUDHHQAOEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16ClN3/c24-18-10-6-7-16(13-18)15-27-23-19-11-4-5-12-21(19)25-14-20(23)22(26-27)17-8-2-1-3-9-17/h1-14H,15H2.
What are the key properties of 1-[(3-chlorophenyl)methyl]-3-phenylpyrazolo[4,5-c]quinoline?
1-[(3-chlorophenyl)methyl]-3-phenylpyrazolo[4,5-c]quinoline has a molecular weight of 369.86 g/mol, XLogP of 5.95, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-chlorophenyl)methyl]-3-phenylpyrazolo[4,5-c]quinoline is sourced from PubChem (CID 20852388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).