6-methoxy-3-methyl-1-(2-methylphenyl)imidazo[5,1-c][1,2,4]benzotriazine

C18H16N4O — CID 46200090

IUPAC6-methoxy-3-methyl-1-(2-methylphenyl)imidazo[5,1-c][1,2,4]benzotriazine
SMILESCOc1cccc2c1nnc1c(C)nc(-c3ccccc3C)n12
InChIInChI=1S/C18H16N4O/c1-11-7-4-5-8-13(11)18-19-12(2)17-21-20-16-14(22(17)18)9-6-10-15(16)23-3/h4-10H,1-3H3
InChIKeyULKIELHDMWBCFZ-UHFFFAOYSA-N
MW304.35 g/mol
LogP3.57
Rot. Bonds2

About 6-methoxy-3-methyl-1-(2-methylphenyl)imidazo[5,1-c][1,2,4]benzotriazine

6-methoxy-3-methyl-1-(2-methylphenyl)imidazo[5,1-c][1,2,4]benzotriazine (PubChem CID 46200090) has the molecular formula C18H16N4O and a molecular weight of 304.35 g/mol. Its IUPAC name is 6-methoxy-3-methyl-1-(2-methylphenyl)imidazo[5,1-c][1,2,4]benzotriazine.

Molecular Properties

Compound Name6-methoxy-3-methyl-1-(2-methylphenyl)imidazo[5,1-c][1,2,4]benzotriazine
PubChem CID46200090
Molecular FormulaC18H16N4O
Molecular Weight304.35 g/mol
Exact Mass304.13
IUPAC Name6-methoxy-3-methyl-1-(2-methylphenyl)imidazo[5,1-c][1,2,4]benzotriazine
SMILESCOc1cccc2c1nnc1c(C)nc(-c3ccccc3C)n12
InChIInChI=1S/C18H16N4O/c1-11-7-4-5-8-13(11)18-19-12(2)17-21-20-16-14(22(17)18)9-6-10-15(16)23-3/h4-10H,1-3H3
InChIKeyULKIELHDMWBCFZ-UHFFFAOYSA-N
XLogP3.57
TPSA52.31 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 6-methoxy-3-methyl-1-(2-methylphenyl)imidazo[5,1-c][1,2,4]benzotriazine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-3-methyl-1-(2-methylphenyl)imidazo[5,1-c][1,2,4]benzotriazine?
The IUPAC name of 6-methoxy-3-methyl-1-(2-methylphenyl)imidazo[5,1-c][1,2,4]benzotriazine (CID 46200090) is 6-methoxy-3-methyl-1-(2-methylphenyl)imidazo[5,1-c][1,2,4]benzotriazine.
What is the SMILES notation for 6-methoxy-3-methyl-1-(2-methylphenyl)imidazo[5,1-c][1,2,4]benzotriazine?
The canonical SMILES for 6-methoxy-3-methyl-1-(2-methylphenyl)imidazo[5,1-c][1,2,4]benzotriazine is COc1cccc2c1nnc1c(C)nc(-c3ccccc3C)n12.
What is the InChIKey of 6-methoxy-3-methyl-1-(2-methylphenyl)imidazo[5,1-c][1,2,4]benzotriazine?
The InChIKey is ULKIELHDMWBCFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O/c1-11-7-4-5-8-13(11)18-19-12(2)17-21-20-16-14(22(17)18)9-6-10-15(16)23-3/h4-10H,1-3H3.
What are the key properties of 6-methoxy-3-methyl-1-(2-methylphenyl)imidazo[5,1-c][1,2,4]benzotriazine?
6-methoxy-3-methyl-1-(2-methylphenyl)imidazo[5,1-c][1,2,4]benzotriazine has a molecular weight of 304.35 g/mol, XLogP of 3.57, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-3-methyl-1-(2-methylphenyl)imidazo[5,1-c][1,2,4]benzotriazine is sourced from PubChem (CID 46200090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).