7-(2-methoxyphenyl)-2-methylsulfinylpyrrolo[2,1-f][1,2,4]triazine

C14H13N3O2S — CID 66710791

IUPAC7-(2-methoxyphenyl)-2-methylsulfinylpyrrolo[2,1-f][1,2,4]triazine
SMILESCOc1ccccc1-c1ccc2cnc(S(C)=O)nn12
InChIInChI=1S/C14H13N3O2S/c1-19-13-6-4-3-5-11(13)12-8-7-10-9-15-14(20(2)18)16-17(10)12/h3-9H,1-2H3
InChIKeyPVWZOJVFNZLPNX-UHFFFAOYSA-N
MW287.34 g/mol
LogP2.14
Rot. Bonds3

About 7-(2-methoxyphenyl)-2-methylsulfinylpyrrolo[2,1-f][1,2,4]triazine

7-(2-methoxyphenyl)-2-methylsulfinylpyrrolo[2,1-f][1,2,4]triazine (PubChem CID 66710791) has the molecular formula C14H13N3O2S and a molecular weight of 287.34 g/mol. Its IUPAC name is 7-(2-methoxyphenyl)-2-methylsulfinylpyrrolo[2,1-f][1,2,4]triazine.

Molecular Properties

Compound Name7-(2-methoxyphenyl)-2-methylsulfinylpyrrolo[2,1-f][1,2,4]triazine
PubChem CID66710791
Molecular FormulaC14H13N3O2S
Molecular Weight287.34 g/mol
Exact Mass287.07
IUPAC Name7-(2-methoxyphenyl)-2-methylsulfinylpyrrolo[2,1-f][1,2,4]triazine
SMILESCOc1ccccc1-c1ccc2cnc(S(C)=O)nn12
InChIInChI=1S/C14H13N3O2S/c1-19-13-6-4-3-5-11(13)12-8-7-10-9-15-14(20(2)18)16-17(10)12/h3-9H,1-2H3
InChIKeyPVWZOJVFNZLPNX-UHFFFAOYSA-N
XLogP2.14
TPSA56.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 7-(2-methoxyphenyl)-2-methylsulfinylpyrrolo[2,1-f][1,2,4]triazine 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

7-(2-Methoxyphenyl)-N-(4-(4-methylpiperazin-1-yl)phenyl)pyrrolo[2,1-f][1,2,4]triazin-2-amine
CID 54577892
7-(2-methoxyphenyl)-N-(4-methoxyphenyl)pyrrolo[2,1-f][1,2,4]triazin-2-amine
CID 57402936
[7-(2-Methoxy-phenyl)-pyrrolo[2,1-f][1,2,4]triazin-2-yl]-[3-(4-methyl-piperazin-1-yl)-phenyl]-amine
CID 57402937
N-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]-7-(2-methoxyphenyl)pyrrolo[2,1-f][1,2,4]triazin-2-amine
CID 57402938
6-(3-Methoxyphenyl)-2,3-dimethylimidazo[1,2-b][1,2,4]triazine
CID 620319
6-(4-methoxyphenyl)-3-(pyridin-2-yl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
CID 663229
5-Imidazol-1-ylmethyl-2-(2-methoxy-phenyl)pyridine
CID 44456188
4-[[7-(2-methoxyphenyl)pyrrolo[2,1-f][1,2,4]triazin-2-yl]amino]-N,N-dimethylbenzenesulfonamide
CID 57399413
6-(2-Methoxyphenyl)-3-(methylthio)-[1,2,4]triazolo[4,3-b]pyridazine
CID 7217469
3-(3-Methoxyphenyl)imidazo[1,2-b]pyridazine
CID 49790940
4-[6-(2-Methoxyphenyl) imidazo[1,2-3]pyridazin-3-yl]phenyl] methanol
CID 126672930
6-(2-Methoxy-phenyl)-3-(3-pyridyl)imidazo [1,2-b]pyridazine
CID 126673085

Frequently Asked Questions

What is the IUPAC name of 7-(2-methoxyphenyl)-2-methylsulfinylpyrrolo[2,1-f][1,2,4]triazine?
The IUPAC name of 7-(2-methoxyphenyl)-2-methylsulfinylpyrrolo[2,1-f][1,2,4]triazine (CID 66710791) is 7-(2-methoxyphenyl)-2-methylsulfinylpyrrolo[2,1-f][1,2,4]triazine.
What is the SMILES notation for 7-(2-methoxyphenyl)-2-methylsulfinylpyrrolo[2,1-f][1,2,4]triazine?
The canonical SMILES for 7-(2-methoxyphenyl)-2-methylsulfinylpyrrolo[2,1-f][1,2,4]triazine is COc1ccccc1-c1ccc2cnc(S(C)=O)nn12.
What is the InChIKey of 7-(2-methoxyphenyl)-2-methylsulfinylpyrrolo[2,1-f][1,2,4]triazine?
The InChIKey is PVWZOJVFNZLPNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O2S/c1-19-13-6-4-3-5-11(13)12-8-7-10-9-15-14(20(2)18)16-17(10)12/h3-9H,1-2H3.
What are the key properties of 7-(2-methoxyphenyl)-2-methylsulfinylpyrrolo[2,1-f][1,2,4]triazine?
7-(2-methoxyphenyl)-2-methylsulfinylpyrrolo[2,1-f][1,2,4]triazine has a molecular weight of 287.34 g/mol, XLogP of 2.14, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-methoxyphenyl)-2-methylsulfinylpyrrolo[2,1-f][1,2,4]triazine is sourced from PubChem (CID 66710791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).