4-bromo-2,6,8-trimethylphenazin-1-ol

C15H13BrN2O — CID 157112481

IUPAC4-bromo-2,6,8-trimethylphenazin-1-ol
SMILESCc1cc(C)c2nc3c(Br)cc(C)c(O)c3nc2c1
InChIInChI=1S/C15H13BrN2O/c1-7-4-8(2)12-11(5-7)17-14-13(18-12)10(16)6-9(3)15(14)19/h4-6,19H,1-3H3
InChIKeyRAZBXSHQYOWSJC-UHFFFAOYSA-N
MW317.19 g/mol
LogP4.18
Rot. Bonds

About 4-bromo-2,6,8-trimethylphenazin-1-ol

4-bromo-2,6,8-trimethylphenazin-1-ol (PubChem CID 157112481) has the molecular formula C15H13BrN2O and a molecular weight of 317.19 g/mol. Its IUPAC name is 4-bromo-2,6,8-trimethylphenazin-1-ol.

Molecular Properties

Compound Name4-bromo-2,6,8-trimethylphenazin-1-ol
PubChem CID157112481
Molecular FormulaC15H13BrN2O
Molecular Weight317.19 g/mol
Exact Mass316.02
IUPAC Name4-bromo-2,6,8-trimethylphenazin-1-ol
SMILESCc1cc(C)c2nc3c(Br)cc(C)c(O)c3nc2c1
InChIInChI=1S/C15H13BrN2O/c1-7-4-8(2)12-11(5-7)17-14-13(18-12)10(16)6-9(3)15(14)19/h4-6,19H,1-3H3
InChIKeyRAZBXSHQYOWSJC-UHFFFAOYSA-N
XLogP4.18
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.19
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 4-bromo-2,6,8-trimethylphenazin-1-ol 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

4-bromo-6-ethyl-2-methylphenazin-1-ol
CID 158705177
5,7-dimethylcyclobuta[b]quinoxaline-1,2-diol
CID 135812200
4-bromo-7-(2-hydroxyethyl)-2-methylphenazin-1-ol
CID 161330549
6,8-dimethylphenazin-1-ol
CID 137281639
1,3,8-trimethylphenazine
CID 146170130
ethyl 9-bromo-6-hydroxy-7-methylphenazine-2-carboxylate
CID 161070409
2,4-dimethylphenazin-1-ol;ethane
CID 145233565
2,3,6,8-tetramethylquinoxalin-5-ol
CID 137126071
4-bromo-2-chlorophenazin-1-ol
CID 137126057
2,6-dibromo-4-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenol
CID 136658134
5-bromo-2-chloro-7-methylquinoxaline
CID 15239008
2-bromo-6,8-dimethylnaphthalen-1-ol
CID 121007840

Frequently Asked Questions

What is the IUPAC name of 4-bromo-2,6,8-trimethylphenazin-1-ol?
The IUPAC name of 4-bromo-2,6,8-trimethylphenazin-1-ol (CID 157112481) is 4-bromo-2,6,8-trimethylphenazin-1-ol.
What is the SMILES notation for 4-bromo-2,6,8-trimethylphenazin-1-ol?
The canonical SMILES for 4-bromo-2,6,8-trimethylphenazin-1-ol is Cc1cc(C)c2nc3c(Br)cc(C)c(O)c3nc2c1.
What is the InChIKey of 4-bromo-2,6,8-trimethylphenazin-1-ol?
The InChIKey is RAZBXSHQYOWSJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrN2O/c1-7-4-8(2)12-11(5-7)17-14-13(18-12)10(16)6-9(3)15(14)19/h4-6,19H,1-3H3.
What are the key properties of 4-bromo-2,6,8-trimethylphenazin-1-ol?
4-bromo-2,6,8-trimethylphenazin-1-ol has a molecular weight of 317.19 g/mol, XLogP of 4.18, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-2,6,8-trimethylphenazin-1-ol is sourced from PubChem (CID 157112481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).