10-[2-carbazol-9-yl-4-(4-cyclohexa-2,4-dien-1-yl-6-phenyl-1,3,5-triazin-2-yl)-6-[3-ethenyl-2-[(Z)-prop-1-enyl]indol-1-yl]phenyl]-9,9-dimethylacridine

C61H48N6 — CID 155205559

About 10-[2-carbazol-9-yl-4-(4-cyclohexa-2,4-dien-1-yl-6-phenyl-1,3,5-triazin-2-yl)-6-[3-ethenyl-2-[(Z)-prop-1-enyl]indol-1-yl]phenyl]-9,9-dimethylacridine

10-[2-carbazol-9-yl-4-(4-cyclohexa-2,4-dien-1-yl-6-phenyl-1,3,5-triazin-2-yl)-6-[3-ethenyl-2-[(Z)-prop-1-enyl]indol-1-yl]phenyl]-9,9-dimethylacridine (PubChem CID 155205559) has the molecular formula C61H48N6 and a molecular weight of 865.10 g/mol. Its IUPAC name is 10-[2-carbazol-9-yl-4-(4-cyclohexa-2,4-dien-1-yl-6-phenyl-1,3,5-triazin-2-yl)-6-[3-ethenyl-2-[(Z)-prop-1-enyl]indol-1-yl]phenyl]-9,9-dimethylacridine.

Molecular Properties

• Compound Name: 10-[2-carbazol-9-yl-4-(4-cyclohexa-2,4-dien-1-yl-6-phenyl-1,3,5-triazin-2-yl)-6-[3-ethenyl-2-[(Z)-prop-1-enyl]indol-1-yl]phenyl]-9,9-dimethylacridine
• PubChem CID: 155205559
• Molecular Formula: C61H48N6
• Molecular Weight: 865.10 g/mol
• Exact Mass: 864.39
• IUPAC Name: 10-[2-carbazol-9-yl-4-(4-cyclohexa-2,4-dien-1-yl-6-phenyl-1,3,5-triazin-2-yl)-6-[3-ethenyl-2-[(Z)-prop-1-enyl]indol-1-yl]phenyl]-9,9-dimethylacridine
• SMILES: C=Cc1c(/C=C\C)n(-c2cc(-c3nc(-c4ccccc4)nc(C4C=CC=CC4)n3)cc(-n3c4ccccc4c4ccccc43)c2N2c3ccccc3C(C)(C)c3ccccc32)c2ccccc12
• InChI: InChI=1S/C61H48N6/c1-5-23-49-43(6-2)44-28-13-18-33-50(44)65(49)55-38-42(60-63-58(40-24-9-7-10-25-40)62-59(64-60)41-26-11-8-12-27-41)39-56(66-51-34-19-14-29-45(51)46-30-15-20-35-52(46)66)57(55)67-53-36-21-16-31-47(53)61(3,4)48-32-17-22-37-54(48)67/h5-26,28-39,41H,2,27H2,1,3-4H3/b23-5-
• InChIKey: TZBUQVNDOIHDLA-FPQMYIDKSA-N
• XLogP: 15.63
• TPSA: 51.77 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 8
• Heavy Atoms: 67
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	865.10
LogP ≤ 5	15.63
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 10-[2-carbazol-9-yl-4-(4-cyclohexa-2,4-dien-1-yl-6-phenyl-1,3,5-triazin-2-yl)-6-[3-ethenyl-2-[(Z)-prop-1-enyl]indol-1-yl]phenyl]-9,9-dimethylacridine?

The IUPAC name of 10-[2-carbazol-9-yl-4-(4-cyclohexa-2,4-dien-1-yl-6-phenyl-1,3,5-triazin-2-yl)-6-[3-ethenyl-2-[(Z)-prop-1-enyl]indol-1-yl]phenyl]-9,9-dimethylacridine (CID 155205559) is 10-[2-carbazol-9-yl-4-(4-cyclohexa-2,4-dien-1-yl-6-phenyl-1,3,5-triazin-2-yl)-6-[3-ethenyl-2-[(Z)-prop-1-enyl]indol-1-yl]phenyl]-9,9-dimethylacridine.

What is the SMILES notation for 10-[2-carbazol-9-yl-4-(4-cyclohexa-2,4-dien-1-yl-6-phenyl-1,3,5-triazin-2-yl)-6-[3-ethenyl-2-[(Z)-prop-1-enyl]indol-1-yl]phenyl]-9,9-dimethylacridine?

The canonical SMILES for 10-[2-carbazol-9-yl-4-(4-cyclohexa-2,4-dien-1-yl-6-phenyl-1,3,5-triazin-2-yl)-6-[3-ethenyl-2-[(Z)-prop-1-enyl]indol-1-yl]phenyl]-9,9-dimethylacridine is C=Cc1c(/C=C\C)n(-c2cc(-c3nc(-c4ccccc4)nc(C4C=CC=CC4)n3)cc(-n3c4ccccc4c4ccccc43)c2N2c3ccccc3C(C)(C)c3ccccc32)c2ccccc12.

What is the InChIKey of 10-[2-carbazol-9-yl-4-(4-cyclohexa-2,4-dien-1-yl-6-phenyl-1,3,5-triazin-2-yl)-6-[3-ethenyl-2-[(Z)-prop-1-enyl]indol-1-yl]phenyl]-9,9-dimethylacridine?

The InChIKey is TZBUQVNDOIHDLA-FPQMYIDKSA-N. The full InChI is InChI=1S/C61H48N6/c1-5-23-49-43(6-2)44-28-13-18-33-50(44)65(49)55-38-42(60-63-58(40-24-9-7-10-25-40)62-59(64-60)41-26-11-8-12-27-41)39-56(66-51-34-19-14-29-45(51)46-30-15-20-35-52(46)66)57(55)67-53-36-21-16-31-47(53)61(3,4)48-32-17-22-37-54(48)67/h5-26,28-39,41H,2,27H2,1,3-4H3/b23-5-.

What are the key properties of 10-[2-carbazol-9-yl-4-(4-cyclohexa-2,4-dien-1-yl-6-phenyl-1,3,5-triazin-2-yl)-6-[3-ethenyl-2-[(Z)-prop-1-enyl]indol-1-yl]phenyl]-9,9-dimethylacridine?

10-[2-carbazol-9-yl-4-(4-cyclohexa-2,4-dien-1-yl-6-phenyl-1,3,5-triazin-2-yl)-6-[3-ethenyl-2-[(Z)-prop-1-enyl]indol-1-yl]phenyl]-9,9-dimethylacridine has a molecular weight of 865.10 g/mol, XLogP of 15.63, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 10-[2-carbazol-9-yl-4-(4-cyclohexa-2,4-dien-1-yl-6-phenyl-1,3,5-triazin-2-yl)-6-[3-ethenyl-2-[(Z)-prop-1-enyl]indol-1-yl]phenyl]-9,9-dimethylacridine is sourced from PubChem (CID 155205559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).