30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-(4-phenylquinazolin-2-yl)-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene

C148H83N11O3 — CID 158654995

About 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-(4-phenylquinazolin-2-yl)-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene

30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-(4-phenylquinazolin-2-yl)-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene (PubChem CID 158654995) has the molecular formula C148H83N11O3 and a molecular weight of 2063.37 g/mol. Its IUPAC name is 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-(4-phenylquinazolin-2-yl)-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene.

Molecular Properties

• Compound Name: 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-(4-phenylquinazolin-2-yl)-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene
• PubChem CID: 158654995
• Molecular Formula: C148H83N11O3
• Molecular Weight: 2063.37 g/mol
• Exact Mass: 2061.67
• IUPAC Name: 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-(4-phenylquinazolin-2-yl)-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene
• SMILES: c1ccc(-c2nc(-c3ccc(-n4c5cccc6c5c5c7c(cccc7c7oc8ccccc8c7c54)-c4ccccc4-6)cc3)nc(-c3ccc4ccccc4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5cccc6c5c5c7c(cccc7c7oc8ccccc8c7c54)-c4ccccc4-6)c4ccccc34)n2)cc1.c1ccc(-c2nc(-n3c4cccc5c4c4c6c(cccc6c6oc7ccccc7c6c43)-c3ccccc3-5)nc3ccccc23)cc1
• InChI: InChI=1S/2C53H30N4O.C42H23N3O/c1-3-15-31(16-4-1)51-54-52(32-17-5-2-6-18-32)56-53(55-51)39-29-30-42(36-22-10-9-21-35(36)39)57-43-27-14-25-38-34-20-8-7-19-33(34)37-24-13-26-41-45(37)48(46(38)43)49(57)47-40-23-11-12-28-44(40)58-50(41)47;1-2-13-32(14-3-1)51-54-52(56-53(55-51)35-25-24-31-12-4-5-15-34(31)30-35)33-26-28-36(29-27-33)57-43-22-11-20-40-38-17-7-6-16-37(38)39-19-10-21-42-45(39)48(46(40)43)49(57)47-41-18-8-9-23-44(41)58-50(42)47;1-2-12-24(13-3-1)39-29-16-6-8-21-32(29)43-42(44-39)45-33-22-11-19-28-26-15-5-4-14-25(26)27-18-10-20-31-35(27)38(36(28)33)40(45)37-30-17-7-9-23-34(30)46-41(31)37/h2*1-30H;1-23H
• InChIKey: ICAFBIDGDBRQFJ-UHFFFAOYSA-N
• XLogP: 38.74
• TPSA: 157.33 Ų
• H-Bond Acceptors: 14
• Rotatable Bonds: 10
• Heavy Atoms: 162
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2063.37
LogP ≤ 5	38.74
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	14

Frequently Asked Questions

What is the IUPAC name of 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-(4-phenylquinazolin-2-yl)-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene?

The IUPAC name of 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-(4-phenylquinazolin-2-yl)-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene (CID 158654995) is 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-(4-phenylquinazolin-2-yl)-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene.

What is the SMILES notation for 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-(4-phenylquinazolin-2-yl)-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene?

The canonical SMILES for 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-(4-phenylquinazolin-2-yl)-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene is c1ccc(-c2nc(-c3ccc(-n4c5cccc6c5c5c7c(cccc7c7oc8ccccc8c7c54)-c4ccccc4-6)cc3)nc(-c3ccc4ccccc4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5cccc6c5c5c7c(cccc7c7oc8ccccc8c7c54)-c4ccccc4-6)c4ccccc34)n2)cc1.c1ccc(-c2nc(-n3c4cccc5c4c4c6c(cccc6c6oc7ccccc7c6c43)-c3ccccc3-5)nc3ccccc23)cc1.

What is the InChIKey of 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-(4-phenylquinazolin-2-yl)-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene?

The InChIKey is ICAFBIDGDBRQFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C53H30N4O.C42H23N3O/c1-3-15-31(16-4-1)51-54-52(32-17-5-2-6-18-32)56-53(55-51)39-29-30-42(36-22-10-9-21-35(36)39)57-43-27-14-25-38-34-20-8-7-19-33(34)37-24-13-26-41-45(37)48(46(38)43)49(57)47-40-23-11-12-28-44(40)58-50(41)47;1-2-13-32(14-3-1)51-54-52(56-53(55-51)35-25-24-31-12-4-5-15-34(31)30-35)33-26-28-36(29-27-33)57-43-22-11-20-40-38-17-7-6-16-37(38)39-19-10-21-42-45(39)48(46(40)43)49(57)47-41-18-8-9-23-44(41)58-50(42)47;1-2-12-24(13-3-1)39-29-16-6-8-21-32(29)43-42(44-39)45-33-22-11-19-28-26-15-5-4-14-25(26)27-18-10-20-31-35(27)38(36(28)33)40(45)37-30-17-7-9-23-34(30)46-41(31)37/h2*1-30H;1-23H.

What are the key properties of 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-(4-phenylquinazolin-2-yl)-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene?

30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-(4-phenylquinazolin-2-yl)-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene has a molecular weight of 2063.37 g/mol, XLogP of 38.74, 10 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 30-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene;30-(4-phenylquinazolin-2-yl)-10-oxa-30-azaoctacyclo[14.12.1.12,27.03,11.04,9.012,29.017,22.023,28]triaconta-1,3(11),4,6,8,12(29),13,15,17,19,21,23(28),24,26-tetradecaene is sourced from PubChem (CID 158654995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).