5,12-diphenylindolo[3,2-c]carbazole

C30H20N2 — CID 22105108

IUPAC5,12-diphenylindolo[3,2-c]carbazole
SMILESc1ccc(-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4ccccc4)c23)cc1
InChIInChI=1S/C30H20N2/c1-3-11-21(12-4-1)31-27-18-10-8-16-25(27)29-28(31)20-19-24-23-15-7-9-17-26(23)32(30(24)29)22-13-5-2-6-14-22/h1-20H
InChIKeyQDRLRNWNBRKYEI-UHFFFAOYSA-N
MW408.50 g/mol
LogP7.88
Rot. Bonds2

About 5,12-diphenylindolo[3,2-c]carbazole

5,12-diphenylindolo[3,2-c]carbazole (PubChem CID 22105108) has the molecular formula C30H20N2 and a molecular weight of 408.50 g/mol. Its IUPAC name is 5,12-diphenylindolo[3,2-c]carbazole.

Molecular Properties

Compound Name5,12-diphenylindolo[3,2-c]carbazole
PubChem CID22105108
Molecular FormulaC30H20N2
Molecular Weight408.50 g/mol
Exact Mass408.16
IUPAC Name5,12-diphenylindolo[3,2-c]carbazole
SMILESc1ccc(-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4ccccc4)c23)cc1
InChIInChI=1S/C30H20N2/c1-3-11-21(12-4-1)31-27-18-10-8-16-25(27)29-28(31)20-19-24-23-15-7-9-17-26(23)32(30(24)29)22-13-5-2-6-14-22/h1-20H
InChIKeyQDRLRNWNBRKYEI-UHFFFAOYSA-N
XLogP7.88
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms32
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500408.50
LogP ≤ 57.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,12-diphenylindolo[3,2-c]carbazole?
The IUPAC name of 5,12-diphenylindolo[3,2-c]carbazole (CID 22105108) is 5,12-diphenylindolo[3,2-c]carbazole.
What is the SMILES notation for 5,12-diphenylindolo[3,2-c]carbazole?
The canonical SMILES for 5,12-diphenylindolo[3,2-c]carbazole is c1ccc(-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4ccccc4)c23)cc1.
What is the InChIKey of 5,12-diphenylindolo[3,2-c]carbazole?
The InChIKey is QDRLRNWNBRKYEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H20N2/c1-3-11-21(12-4-1)31-27-18-10-8-16-25(27)29-28(31)20-19-24-23-15-7-9-17-26(23)32(30(24)29)22-13-5-2-6-14-22/h1-20H.
What are the key properties of 5,12-diphenylindolo[3,2-c]carbazole?
5,12-diphenylindolo[3,2-c]carbazole has a molecular weight of 408.50 g/mol, XLogP of 7.88, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,12-diphenylindolo[3,2-c]carbazole is sourced from PubChem (CID 22105108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).