14-phenyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxyspiro[1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene-8,5'-benzo[b][1]benzogermole]

C48H32GeN4O — CID 155616684

About 14-phenyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxyspiro[1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene-8,5'-benzo[b][1]benzogermole]

14-phenyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxyspiro[1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene-8,5'-benzo[b][1]benzogermole] (PubChem CID 155616684) has the molecular formula C48H32GeN4O and a molecular weight of 753.42 g/mol. Its IUPAC name is 14-phenyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxyspiro[1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene-8,5'-benzo[b][1]benzogermole].

Molecular Properties

• Compound Name: 14-phenyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxyspiro[1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene-8,5'-benzo[b][1]benzogermole]
• PubChem CID: 155616684
• Molecular Formula: C48H32GeN4O
• Molecular Weight: 753.42 g/mol
• Exact Mass: 754.18
• IUPAC Name: 14-phenyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxyspiro[1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene-8,5'-benzo[b][1]benzogermole]
• SMILES: c1ccc(N2CN3c4cc(Oc5ccc6c7ccccc7n(-c7ccccn7)c6c5)ccc4[Ge]4(c5ccccc5-c5ccccc54)c4cccc2c43)cc1
• InChI: InChI=1S/C48H32GeN4O/c1-2-13-32(14-3-1)51-31-52-46-30-34(54-33-24-26-38-37-17-6-9-21-43(37)53(45(38)29-33)47-23-10-11-28-50-47)25-27-41(46)49(42-20-12-22-44(51)48(42)52)39-18-7-4-15-35(39)36-16-5-8-19-40(36)49/h1-30H,31H2
• InChIKey: QVOFVBJONJOLCR-UHFFFAOYSA-N
• XLogP: 8.89
• TPSA: 33.53 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 4
• Heavy Atoms: 54
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	753.42
LogP ≤ 5	8.89
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 14-phenyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxyspiro[1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene-8,5'-benzo[b][1]benzogermole]?

The IUPAC name of 14-phenyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxyspiro[1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene-8,5'-benzo[b][1]benzogermole] (CID 155616684) is 14-phenyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxyspiro[1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene-8,5'-benzo[b][1]benzogermole].

What is the SMILES notation for 14-phenyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxyspiro[1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene-8,5'-benzo[b][1]benzogermole]?

The canonical SMILES for 14-phenyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxyspiro[1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene-8,5'-benzo[b][1]benzogermole] is c1ccc(N2CN3c4cc(Oc5ccc6c7ccccc7n(-c7ccccn7)c6c5)ccc4[Ge]4(c5ccccc5-c5ccccc54)c4cccc2c43)cc1.

What is the InChIKey of 14-phenyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxyspiro[1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene-8,5'-benzo[b][1]benzogermole]?

The InChIKey is QVOFVBJONJOLCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H32GeN4O/c1-2-13-32(14-3-1)51-31-52-46-30-34(54-33-24-26-38-37-17-6-9-21-43(37)53(45(38)29-33)47-23-10-11-28-50-47)25-27-41(46)49(42-20-12-22-44(51)48(42)52)39-18-7-4-15-35(39)36-16-5-8-19-40(36)49/h1-30H,31H2.

What are the key properties of 14-phenyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxyspiro[1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene-8,5'-benzo[b][1]benzogermole]?

14-phenyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxyspiro[1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene-8,5'-benzo[b][1]benzogermole] has a molecular weight of 753.42 g/mol, XLogP of 8.89, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 14-phenyl-4-(9-pyridin-2-ylcarbazol-2-yl)oxyspiro[1,14-diaza-8-germatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaene-8,5'-benzo[b][1]benzogermole] is sourced from PubChem (CID 155616684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).