24-benzo[h]quinazolin-2-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;24-phenanthro[9,10-c]pyridin-3-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;9-phenyl-24-(1-phenylbenzo[f]quinazolin-3-yl)-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene

C128H76N14 — CID 167710384

About 24-benzo[h]quinazolin-2-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;24-phenanthro[9,10-c]pyridin-3-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;9-phenyl-24-(1-phenylbenzo[f]quinazolin-3-yl)-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene

24-benzo[h]quinazolin-2-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;24-phenanthro[9,10-c]pyridin-3-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;9-phenyl-24-(1-phenylbenzo[f]quinazolin-3-yl)-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene (PubChem CID 167710384) has the molecular formula C128H76N14 and a molecular weight of 1810.11 g/mol. Its IUPAC name is 24-benzo[h]quinazolin-2-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;24-phenanthro[9,10-c]pyridin-3-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;9-phenyl-24-(1-phenylbenzo[f]quinazolin-3-yl)-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene.

Molecular Properties

• Compound Name: 24-benzo[h]quinazolin-2-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;24-phenanthro[9,10-c]pyridin-3-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;9-phenyl-24-(1-phenylbenzo[f]quinazolin-3-yl)-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene
• PubChem CID: 167710384
• Molecular Formula: C128H76N14
• Molecular Weight: 1810.11 g/mol
• Exact Mass: 1808.64
• IUPAC Name: 24-benzo[h]quinazolin-2-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;24-phenanthro[9,10-c]pyridin-3-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;9-phenyl-24-(1-phenylbenzo[f]quinazolin-3-yl)-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene
• SMILES: c1ccc(-c2nc(-n3c4ccccc4c4c5cccnc5c5c(c6ccccc6n5-c5ccccc5)c43)nc3ccc4ccccc4c23)cc1.c1ccc(-n2c3ccccc3c3c2c2ncccc2c2c4ccccc4n(-c4cc5c6ccccc6c6ccccc6c5cn4)c23)cc1.c1ccc(-n2c3ccccc3c3c2c2ncccc2c2c4ccccc4n(-c4ncc5ccc6ccccc6c5n4)c23)cc1
• InChI: InChI=1S/C45H27N5.C44H26N4.C39H23N5/c1-3-15-29(16-4-1)41-39-31-19-8-7-14-28(31)25-26-35(39)47-45(48-41)50-37-24-12-9-20-32(37)38-34-22-13-27-46-42(34)44-40(43(38)50)33-21-10-11-23-36(33)49(44)30-17-5-2-6-18-30;1-2-13-27(14-3-1)47-37-22-10-9-20-33(37)41-43-40(34-21-12-24-45-42(34)44(41)47)32-19-8-11-23-38(32)48(43)39-25-35-30-17-6-4-15-28(30)29-16-5-7-18-31(29)36(35)26-46-39;1-2-12-26(13-3-1)43-31-18-8-7-16-29(31)34-37-33(30-17-10-22-40-36(30)38(34)43)28-15-6-9-19-32(28)44(37)39-41-23-25-21-20-24-11-4-5-14-27(24)35(25)42-39/h1-27H;1-26H;1-23H
• InChIKey: ZSXXBUCBHZSZDJ-UHFFFAOYSA-N
• XLogP: 32.00
• TPSA: 132.70 Ų
• H-Bond Acceptors: 14
• Rotatable Bonds: 7
• Heavy Atoms: 142
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1810.11
LogP ≤ 5	32.00
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 24-benzo[h]quinazolin-2-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;24-phenanthro[9,10-c]pyridin-3-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;9-phenyl-24-(1-phenylbenzo[f]quinazolin-3-yl)-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene?

The IUPAC name of 24-benzo[h]quinazolin-2-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;24-phenanthro[9,10-c]pyridin-3-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;9-phenyl-24-(1-phenylbenzo[f]quinazolin-3-yl)-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene (CID 167710384) is 24-benzo[h]quinazolin-2-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;24-phenanthro[9,10-c]pyridin-3-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;9-phenyl-24-(1-phenylbenzo[f]quinazolin-3-yl)-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene.

What is the SMILES notation for 24-benzo[h]quinazolin-2-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;24-phenanthro[9,10-c]pyridin-3-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;9-phenyl-24-(1-phenylbenzo[f]quinazolin-3-yl)-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene?

The canonical SMILES for 24-benzo[h]quinazolin-2-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;24-phenanthro[9,10-c]pyridin-3-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;9-phenyl-24-(1-phenylbenzo[f]quinazolin-3-yl)-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene is c1ccc(-c2nc(-n3c4ccccc4c4c5cccnc5c5c(c6ccccc6n5-c5ccccc5)c43)nc3ccc4ccccc4c23)cc1.c1ccc(-n2c3ccccc3c3c2c2ncccc2c2c4ccccc4n(-c4cc5c6ccccc6c6ccccc6c5cn4)c23)cc1.c1ccc(-n2c3ccccc3c3c2c2ncccc2c2c4ccccc4n(-c4ncc5ccc6ccccc6c5n4)c23)cc1.

What is the InChIKey of 24-benzo[h]quinazolin-2-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;24-phenanthro[9,10-c]pyridin-3-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;9-phenyl-24-(1-phenylbenzo[f]quinazolin-3-yl)-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene?

The InChIKey is ZSXXBUCBHZSZDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H27N5.C44H26N4.C39H23N5/c1-3-15-29(16-4-1)41-39-31-19-8-7-14-28(31)25-26-35(39)47-45(48-41)50-37-24-12-9-20-32(37)38-34-22-13-27-46-42(34)44-40(43(38)50)33-21-10-11-23-36(33)49(44)30-17-5-2-6-18-30;1-2-13-27(14-3-1)47-37-22-10-9-20-33(37)41-43-40(34-21-12-24-45-42(34)44(41)47)32-19-8-11-23-38(32)48(43)39-25-35-30-17-6-4-15-28(30)29-16-5-7-18-31(29)36(35)26-46-39;1-2-12-26(13-3-1)43-31-18-8-7-16-29(31)34-37-33(30-17-10-22-40-36(30)38(34)43)28-15-6-9-19-32(28)44(37)39-41-23-25-21-20-24-11-4-5-14-27(24)35(25)42-39/h1-27H;1-26H;1-23H.

What are the key properties of 24-benzo[h]quinazolin-2-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;24-phenanthro[9,10-c]pyridin-3-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;9-phenyl-24-(1-phenylbenzo[f]quinazolin-3-yl)-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene?

24-benzo[h]quinazolin-2-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;24-phenanthro[9,10-c]pyridin-3-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;9-phenyl-24-(1-phenylbenzo[f]quinazolin-3-yl)-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene has a molecular weight of 1810.11 g/mol, XLogP of 32.00, 7 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 24-benzo[h]quinazolin-2-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;24-phenanthro[9,10-c]pyridin-3-yl-9-phenyl-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene;9-phenyl-24-(1-phenylbenzo[f]quinazolin-3-yl)-9,12,24-triazahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1,3,5,7,10,12,14,16,18,20,22-undecaene is sourced from PubChem (CID 167710384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).