7-methyl-10-(11-methylbenzo[a]carbazol-3-yl)benzo[c]carbazole

C34H24N2 — CID 134240713

IUPAC7-methyl-10-(11-methylbenzo[a]carbazol-3-yl)benzo[c]carbazole
SMILESCn1c2ccc(-c3ccc4c(ccc5c6ccccc6n(C)c45)c3)cc2c2c3ccccc3ccc21
InChIInChI=1S/C34H24N2/c1-35-31-17-14-23(20-29(31)33-25-8-4-3-7-21(25)13-18-32(33)35)22-11-15-26-24(19-22)12-16-28-27-9-5-6-10-30(27)36(2)34(26)28/h3-20H,1-2H3
InChIKeySTCFWYSEFWDKIY-UHFFFAOYSA-N
MW460.58 g/mol
LogP8.95
Rot. Bonds1

About 7-methyl-10-(11-methylbenzo[a]carbazol-3-yl)benzo[c]carbazole

7-methyl-10-(11-methylbenzo[a]carbazol-3-yl)benzo[c]carbazole (PubChem CID 134240713) has the molecular formula C34H24N2 and a molecular weight of 460.58 g/mol. Its IUPAC name is 7-methyl-10-(11-methylbenzo[a]carbazol-3-yl)benzo[c]carbazole.

Molecular Properties

Compound Name7-methyl-10-(11-methylbenzo[a]carbazol-3-yl)benzo[c]carbazole
PubChem CID134240713
Molecular FormulaC34H24N2
Molecular Weight460.58 g/mol
Exact Mass460.19
IUPAC Name7-methyl-10-(11-methylbenzo[a]carbazol-3-yl)benzo[c]carbazole
SMILESCn1c2ccc(-c3ccc4c(ccc5c6ccccc6n(C)c45)c3)cc2c2c3ccccc3ccc21
InChIInChI=1S/C34H24N2/c1-35-31-17-14-23(20-29(31)33-25-8-4-3-7-21(25)13-18-32(33)35)22-11-15-26-24(19-22)12-16-28-27-9-5-6-10-30(27)36(2)34(26)28/h3-20H,1-2H3
InChIKeySTCFWYSEFWDKIY-UHFFFAOYSA-N
XLogP8.95
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms36
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500460.58
LogP ≤ 58.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-10-(11-methylbenzo[a]carbazol-3-yl)benzo[c]carbazole?
The IUPAC name of 7-methyl-10-(11-methylbenzo[a]carbazol-3-yl)benzo[c]carbazole (CID 134240713) is 7-methyl-10-(11-methylbenzo[a]carbazol-3-yl)benzo[c]carbazole.
What is the SMILES notation for 7-methyl-10-(11-methylbenzo[a]carbazol-3-yl)benzo[c]carbazole?
The canonical SMILES for 7-methyl-10-(11-methylbenzo[a]carbazol-3-yl)benzo[c]carbazole is Cn1c2ccc(-c3ccc4c(ccc5c6ccccc6n(C)c45)c3)cc2c2c3ccccc3ccc21.
What is the InChIKey of 7-methyl-10-(11-methylbenzo[a]carbazol-3-yl)benzo[c]carbazole?
The InChIKey is STCFWYSEFWDKIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H24N2/c1-35-31-17-14-23(20-29(31)33-25-8-4-3-7-21(25)13-18-32(33)35)22-11-15-26-24(19-22)12-16-28-27-9-5-6-10-30(27)36(2)34(26)28/h3-20H,1-2H3.
What are the key properties of 7-methyl-10-(11-methylbenzo[a]carbazol-3-yl)benzo[c]carbazole?
7-methyl-10-(11-methylbenzo[a]carbazol-3-yl)benzo[c]carbazole has a molecular weight of 460.58 g/mol, XLogP of 8.95, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-10-(11-methylbenzo[a]carbazol-3-yl)benzo[c]carbazole is sourced from PubChem (CID 134240713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).