5-[10-(9,9-dimethylfluoren-4-yl)-3-methylanthracen-9-yl]-10-methylphenazine

C43H34N2 — CID 59195797

IUPAC5-[10-(9,9-dimethylfluoren-4-yl)-3-methylanthracen-9-yl]-10-methylphenazine
SMILESCc1ccc2c(N3c4ccccc4N(C)c4ccccc43)c3ccccc3c(-c3cccc4c3-c3ccccc3C4(C)C)c2c1
InChIInChI=1S/C43H34N2/c1-27-24-25-30-33(26-27)40(32-17-13-19-35-41(32)31-16-7-8-18-34(31)43(35,2)3)28-14-5-6-15-29(28)42(30)45-38-22-11-9-20-36(38)44(4)37-21-10-12-23-39(37)45/h5-26H,1-4H3
InChIKeyJPTFCPDPWWJJJS-UHFFFAOYSA-N
MW578.76 g/mol
LogP11.83
Rot. Bonds2

About 5-[10-(9,9-dimethylfluoren-4-yl)-3-methylanthracen-9-yl]-10-methylphenazine

5-[10-(9,9-dimethylfluoren-4-yl)-3-methylanthracen-9-yl]-10-methylphenazine (PubChem CID 59195797) has the molecular formula C43H34N2 and a molecular weight of 578.76 g/mol. Its IUPAC name is 5-[10-(9,9-dimethylfluoren-4-yl)-3-methylanthracen-9-yl]-10-methylphenazine.

Molecular Properties

Compound Name5-[10-(9,9-dimethylfluoren-4-yl)-3-methylanthracen-9-yl]-10-methylphenazine
PubChem CID59195797
Molecular FormulaC43H34N2
Molecular Weight578.76 g/mol
Exact Mass578.27
IUPAC Name5-[10-(9,9-dimethylfluoren-4-yl)-3-methylanthracen-9-yl]-10-methylphenazine
SMILESCc1ccc2c(N3c4ccccc4N(C)c4ccccc43)c3ccccc3c(-c3cccc4c3-c3ccccc3C4(C)C)c2c1
InChIInChI=1S/C43H34N2/c1-27-24-25-30-33(26-27)40(32-17-13-19-35-41(32)31-16-7-8-18-34(31)43(35,2)3)28-14-5-6-15-29(28)42(30)45-38-22-11-9-20-36(38)44(4)37-21-10-12-23-39(37)45/h5-26H,1-4H3
InChIKeyJPTFCPDPWWJJJS-UHFFFAOYSA-N
XLogP11.83
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500578.76
LogP ≤ 511.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 5-[10-(9,9-dimethylfluoren-4-yl)-3-methylanthracen-9-yl]-10-methylphenazine 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

10-[10-(9,9-dimethylfluoren-4-yl)-3-methylanthracen-9-yl]phenoxazine
CID 59196124
5-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-2-ylanthracen-9-yl]-10-methylphenazine
CID 59195181
9-(9,9-dimethylfluoren-4-yl)-2-methyl-10-(4-phenylphenyl)anthracene
CID 59196543
9-(9,9-dimethylfluoren-4-yl)-2-methyl-10-(4-phenylnaphthalen-1-yl)anthracene
CID 59195621
10-[10-(9,9-dimethylfluoren-4-yl)-3-phenylanthracen-9-yl]phenothiazine
CID 59195940
2-[10-(9,9-dimethylfluoren-4-yl)-3-phenylanthracen-9-yl]-5,10-dimethylphenazine
CID 59194678
1-[10-(9,9-dimethylfluoren-4-yl)-8-(9,9,10-trimethylacridin-1-yl)anthracen-1-yl]-9,9,10-trimethylacridine
CID 155334294
9-(9,9-dimethylfluoren-4-yl)-10-(3,4-diphenylphenyl)-2-methylanthracene
CID 59195127
5-[3-(9,9-dimethylfluoren-2-yl)-10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]-10-methylphenazine
CID 59195441
3-[10-(9,9-dimethylfluoren-4-yl)-3-naphthalen-1-ylanthracen-9-yl]-9,9,10-trimethylacridine
CID 59196517
4-[10-(9,9-dimethylfluoren-4-yl)-3-methylanthracen-9-yl]dibenzofuran
CID 59195028
5-[9-(9,9-dimethylfluoren-2-yl)-6-(10-methylphenazin-5-yl)-10-(4-methylphenyl)anthracen-2-yl]-10-methylphenazine
CID 59220288

Frequently Asked Questions

What is the IUPAC name of 5-[10-(9,9-dimethylfluoren-4-yl)-3-methylanthracen-9-yl]-10-methylphenazine?
The IUPAC name of 5-[10-(9,9-dimethylfluoren-4-yl)-3-methylanthracen-9-yl]-10-methylphenazine (CID 59195797) is 5-[10-(9,9-dimethylfluoren-4-yl)-3-methylanthracen-9-yl]-10-methylphenazine.
What is the SMILES notation for 5-[10-(9,9-dimethylfluoren-4-yl)-3-methylanthracen-9-yl]-10-methylphenazine?
The canonical SMILES for 5-[10-(9,9-dimethylfluoren-4-yl)-3-methylanthracen-9-yl]-10-methylphenazine is Cc1ccc2c(N3c4ccccc4N(C)c4ccccc43)c3ccccc3c(-c3cccc4c3-c3ccccc3C4(C)C)c2c1.
What is the InChIKey of 5-[10-(9,9-dimethylfluoren-4-yl)-3-methylanthracen-9-yl]-10-methylphenazine?
The InChIKey is JPTFCPDPWWJJJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H34N2/c1-27-24-25-30-33(26-27)40(32-17-13-19-35-41(32)31-16-7-8-18-34(31)43(35,2)3)28-14-5-6-15-29(28)42(30)45-38-22-11-9-20-36(38)44(4)37-21-10-12-23-39(37)45/h5-26H,1-4H3.
What are the key properties of 5-[10-(9,9-dimethylfluoren-4-yl)-3-methylanthracen-9-yl]-10-methylphenazine?
5-[10-(9,9-dimethylfluoren-4-yl)-3-methylanthracen-9-yl]-10-methylphenazine has a molecular weight of 578.76 g/mol, XLogP of 11.83, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[10-(9,9-dimethylfluoren-4-yl)-3-methylanthracen-9-yl]-10-methylphenazine is sourced from PubChem (CID 59195797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).