2-[6-[4-[6-(12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-12-yl)naphthalen-2-yl]-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[6-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[4-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-(12-phenyl-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-5-yl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole

C240H138N24O8 — CID 159183156

IUPAC2-[6-[4-[6-(12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-12-yl)naphthalen-2-yl]-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[6-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[4-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-(12-phenyl-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-5-yl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole
SMILESc1ccc(-n2c3ccc4ccccc4c3c3c4cc(-c5nc(-c6ccc(-c7nc8ccccc8o7)cc6)nc(-c6ccc(-c7nc8ccccc8o7)cc6)n5)ccc4ccc32)cc1.c1ccc2c(c1)ccc1c2c2c3ccccc3ccc2n1-c1ccc2cc(-c3nc(-c4ccc5cc(-c6nc7ccccc7o6)ccc5c4)nc(-c4ccc5cc(-c6nc7ccccc7o6)ccc5c4)n3)ccc2c1.c1ccc2c(c1)ccc1c2c2ccccc2n1-c1ccc2cc(-c3nc(-c4ccc(-c5nc6ccccc6o5)cc4)nc(-c4ccc(-c5nc6ccccc6o5)cc4)n3)ccc2c1.c1ccc2c(c1)ccc1c2c2ccccc2n1-c1ccc2cc(-c3nc(-c4ccc5cc(-c6nc7ccccc7o6)ccc5c4)nc(-c4ccc5cc(-c6nc7ccccc7o6)ccc5c4)n3)ccc2c1
InChIInChI=1S/C67H38N6O2.C63H36N6O2.2C55H32N6O2/c1-3-11-53-39(9-1)28-31-57-61(53)62-54-12-4-2-10-40(54)29-32-58(62)73(57)52-30-27-45-35-49(24-19-46(45)38-52)65-71-63(47-22-17-43-36-50(25-20-41(43)33-47)66-68-55-13-5-7-15-59(55)74-66)70-64(72-65)48-23-18-44-37-51(26-21-42(44)34-48)67-69-56-14-6-8-16-60(56)75-67;1-2-10-50-37(9-1)28-30-55-58(50)51-11-3-6-14-54(51)69(55)49-29-27-42-33-46(24-19-43(42)36-49)61-67-59(44-22-17-40-34-47(25-20-38(40)31-44)62-64-52-12-4-7-15-56(52)70-62)66-60(68-61)45-23-18-41-35-48(26-21-39(41)32-45)63-65-53-13-5-8-16-57(53)71-63;1-2-10-42-33(9-1)28-30-47-50(42)43-11-3-6-14-46(43)61(47)41-29-27-38-31-40(26-25-39(38)32-41)53-59-51(34-17-21-36(22-18-34)54-56-44-12-4-7-15-48(44)62-54)58-52(60-53)35-19-23-37(24-20-35)55-57-45-13-5-8-16-49(45)63-55;1-2-11-40(12-3-1)61-45-30-28-33-10-4-5-13-41(33)49(45)50-42-32-39(27-18-34(42)29-31-46(50)61)53-59-51(35-19-23-37(24-20-35)54-56-43-14-6-8-16-47(43)62-54)58-52(60-53)36-21-25-38(26-22-36)55-57-44-15-7-9-17-48(44)63-55/h1-38H;1-36H;2*1-32H
InChIKeyKNDPWGTUJSZIOH-UHFFFAOYSA-N
MW3485.90 g/mol
LogP61.34
Rot. Bonds24

About 2-[6-[4-[6-(12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-12-yl)naphthalen-2-yl]-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[6-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[4-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-(12-phenyl-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-5-yl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole

2-[6-[4-[6-(12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-12-yl)naphthalen-2-yl]-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[6-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[4-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-(12-phenyl-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-5-yl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole (PubChem CID 159183156) has the molecular formula C240H138N24O8 and a molecular weight of 3485.90 g/mol. Its IUPAC name is 2-[6-[4-[6-(12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-12-yl)naphthalen-2-yl]-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[6-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[4-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-(12-phenyl-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-5-yl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole.

Molecular Properties

Compound Name2-[6-[4-[6-(12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-12-yl)naphthalen-2-yl]-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[6-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[4-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-(12-phenyl-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-5-yl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole
PubChem CID159183156
Molecular FormulaC240H138N24O8
Molecular Weight3485.90 g/mol
Exact Mass3483.11
IUPAC Name2-[6-[4-[6-(12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-12-yl)naphthalen-2-yl]-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[6-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[4-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-(12-phenyl-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-5-yl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole
SMILESc1ccc(-n2c3ccc4ccccc4c3c3c4cc(-c5nc(-c6ccc(-c7nc8ccccc8o7)cc6)nc(-c6ccc(-c7nc8ccccc8o7)cc6)n5)ccc4ccc32)cc1.c1ccc2c(c1)ccc1c2c2c3ccccc3ccc2n1-c1ccc2cc(-c3nc(-c4ccc5cc(-c6nc7ccccc7o6)ccc5c4)nc(-c4ccc5cc(-c6nc7ccccc7o6)ccc5c4)n3)ccc2c1.c1ccc2c(c1)ccc1c2c2ccccc2n1-c1ccc2cc(-c3nc(-c4ccc(-c5nc6ccccc6o5)cc4)nc(-c4ccc(-c5nc6ccccc6o5)cc4)n3)ccc2c1.c1ccc2c(c1)ccc1c2c2ccccc2n1-c1ccc2cc(-c3nc(-c4ccc5cc(-c6nc7ccccc7o6)ccc5c4)nc(-c4ccc5cc(-c6nc7ccccc7o6)ccc5c4)n3)ccc2c1
InChIInChI=1S/C67H38N6O2.C63H36N6O2.2C55H32N6O2/c1-3-11-53-39(9-1)28-31-57-61(53)62-54-12-4-2-10-40(54)29-32-58(62)73(57)52-30-27-45-35-49(24-19-46(45)38-52)65-71-63(47-22-17-43-36-50(25-20-41(43)33-47)66-68-55-13-5-7-15-59(55)74-66)70-64(72-65)48-23-18-44-37-51(26-21-42(44)34-48)67-69-56-14-6-8-16-60(56)75-67;1-2-10-50-37(9-1)28-30-55-58(50)51-11-3-6-14-54(51)69(55)49-29-27-42-33-46(24-19-43(42)36-49)61-67-59(44-22-17-40-34-47(25-20-38(40)31-44)62-64-52-12-4-7-15-56(52)70-62)66-60(68-61)45-23-18-41-35-48(26-21-39(41)32-45)63-65-53-13-5-8-16-57(53)71-63;1-2-10-42-33(9-1)28-30-47-50(42)43-11-3-6-14-46(43)61(47)41-29-27-38-31-40(26-25-39(38)32-41)53-59-51(34-17-21-36(22-18-34)54-56-44-12-4-7-15-48(44)62-54)58-52(60-53)35-19-23-37(24-20-35)55-57-45-13-5-8-16-49(45)63-55;1-2-11-40(12-3-1)61-45-30-28-33-10-4-5-13-41(33)49(45)50-42-32-39(27-18-34(42)29-31-46(50)61)53-59-51(35-19-23-37(24-20-35)54-56-43-14-6-8-16-47(43)62-54)58-52(60-53)36-21-25-38(26-22-36)55-57-44-15-7-9-17-48(44)63-55/h1-38H;1-36H;2*1-32H
InChIKeyKNDPWGTUJSZIOH-UHFFFAOYSA-N
XLogP61.34
TPSA382.64 Ų
H-Bond Donors
H-Bond Acceptors32
Rotatable Bonds24
Heavy Atoms272
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003485.90
LogP ≤ 561.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1032

Analyze 2-[6-[4-[6-(12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-12-yl)naphthalen-2-yl]-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[6-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[4-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-(12-phenyl-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-5-yl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole with MolForge

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Related Compounds

2-[6-[4-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-[4-(11-phenylbenzo[a]carbazol-8-yl)phenyl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[6-[4-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-[4-(5-phenylbenzo[b]carbazol-2-yl)phenyl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[6-[4-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-(7-phenylbenzo[c]carbazol-2-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[6-[4-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-(7-phenylbenzo[c]carbazol-10-yl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole
CID 157287840
2-[9-[4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazol-2-yl]-1,3-benzoxazole
CID 156661248
2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-[4-[12-(3-phenylphenyl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-6-yl]phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-[4-[12-(3-phenylphenyl)-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-6-yl]phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-[4-[12-(4-phenylphenyl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-6-yl]phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-[4-[12-(4-phenylphenyl)-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-6-yl]phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-[12-(3-phenylphenyl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-6-yl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-[12-(3-phenylphenyl)-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5(10),6,8,14,16,18,20-decaen-7-yl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-[12-(4-phenylphenyl)-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-6-yl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-[12-(4-phenylphenyl)-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-6-yl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole
CID 161063374
2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-[4-[12-(3-phenylphenyl)-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-6-yl]phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-[12-(3-phenylphenyl)-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-6-yl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-[12-(4-phenylphenyl)-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-6-yl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-[4-[11-(3-phenylphenyl)benzo[a]carbazol-8-yl]phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-[4-[11-(4-phenylphenyl)benzo[a]carbazol-8-yl]phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-[4-[5-(3-phenylphenyl)benzo[b]carbazol-2-yl]phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-[4-[5-(3-phenylphenyl)benzo[b]carbazol-9-yl]phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-[4-[5-(4-phenylphenyl)benzo[b]carbazol-2-yl]phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole
CID 159394481
2-[4-[3-(6-naphthalen-2-ylnaphthalen-2-yl)carbazol-9-yl]phenyl]-1,3-benzoxazole
CID 177074698
2-[9-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]carbazol-3-yl]-1,3-benzoxazole
CID 155444605
2-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-2-yl]-1,3-benzoxazole
CID 155444658
2-[7-[4-[7-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole
CID 147387769
2-[6-(1,3-benzoxazol-2-yl)-9-phenylcarbazol-3-yl]-1,3-benzoxazole
CID 155366285
2-[6-(1,3-benzoxazol-2-yl)-9-[4-(9-phenylcarbazol-2-yl)phenyl]carbazol-3-yl]-1,3-benzoxazole
CID 155366571
2-[9-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]-1,3-benzoxazole;2-[9-[4-phenyl-6-(9-phenylcarbazol-2-yl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-1,3-benzoxazole;2-[9-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-1,3-benzoxazole;2-[9-[4-phenyl-6-(9-phenylcarbazol-4-yl)-1,3,5-triazin-2-yl]dibenzofuran-3-yl]-1,3-benzoxazole
CID 160699885
7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-phenanthren-3-ylbenzo[c]carbazole
CID 131979639

Frequently Asked Questions

What is the IUPAC name of 2-[6-[4-[6-(12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-12-yl)naphthalen-2-yl]-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[6-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[4-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-(12-phenyl-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-5-yl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole?
The IUPAC name of 2-[6-[4-[6-(12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-12-yl)naphthalen-2-yl]-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[6-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[4-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-(12-phenyl-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-5-yl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole (CID 159183156) is 2-[6-[4-[6-(12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-12-yl)naphthalen-2-yl]-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[6-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[4-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-(12-phenyl-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-5-yl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole.
What is the SMILES notation for 2-[6-[4-[6-(12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-12-yl)naphthalen-2-yl]-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[6-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[4-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-(12-phenyl-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-5-yl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole?
The canonical SMILES for 2-[6-[4-[6-(12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-12-yl)naphthalen-2-yl]-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[6-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[4-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-(12-phenyl-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-5-yl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole is c1ccc(-n2c3ccc4ccccc4c3c3c4cc(-c5nc(-c6ccc(-c7nc8ccccc8o7)cc6)nc(-c6ccc(-c7nc8ccccc8o7)cc6)n5)ccc4ccc32)cc1.c1ccc2c(c1)ccc1c2c2c3ccccc3ccc2n1-c1ccc2cc(-c3nc(-c4ccc5cc(-c6nc7ccccc7o6)ccc5c4)nc(-c4ccc5cc(-c6nc7ccccc7o6)ccc5c4)n3)ccc2c1.c1ccc2c(c1)ccc1c2c2ccccc2n1-c1ccc2cc(-c3nc(-c4ccc(-c5nc6ccccc6o5)cc4)nc(-c4ccc(-c5nc6ccccc6o5)cc4)n3)ccc2c1.c1ccc2c(c1)ccc1c2c2ccccc2n1-c1ccc2cc(-c3nc(-c4ccc5cc(-c6nc7ccccc7o6)ccc5c4)nc(-c4ccc5cc(-c6nc7ccccc7o6)ccc5c4)n3)ccc2c1.
What is the InChIKey of 2-[6-[4-[6-(12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-12-yl)naphthalen-2-yl]-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[6-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[4-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-(12-phenyl-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-5-yl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole?
The InChIKey is KNDPWGTUJSZIOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C67H38N6O2.C63H36N6O2.2C55H32N6O2/c1-3-11-53-39(9-1)28-31-57-61(53)62-54-12-4-2-10-40(54)29-32-58(62)73(57)52-30-27-45-35-49(24-19-46(45)38-52)65-71-63(47-22-17-43-36-50(25-20-41(43)33-47)66-68-55-13-5-7-15-59(55)74-66)70-64(72-65)48-23-18-44-37-51(26-21-42(44)34-48)67-69-56-14-6-8-16-60(56)75-67;1-2-10-50-37(9-1)28-30-55-58(50)51-11-3-6-14-54(51)69(55)49-29-27-42-33-46(24-19-43(42)36-49)61-67-59(44-22-17-40-34-47(25-20-38(40)31-44)62-64-52-12-4-7-15-56(52)70-62)66-60(68-61)45-23-18-41-35-48(26-21-39(41)32-45)63-65-53-13-5-8-16-57(53)71-63;1-2-10-42-33(9-1)28-30-47-50(42)43-11-3-6-14-46(43)61(47)41-29-27-38-31-40(26-25-39(38)32-41)53-59-51(34-17-21-36(22-18-34)54-56-44-12-4-7-15-48(44)62-54)58-52(60-53)35-19-23-37(24-20-35)55-57-45-13-5-8-16-49(45)63-55;1-2-11-40(12-3-1)61-45-30-28-33-10-4-5-13-41(33)49(45)50-42-32-39(27-18-34(42)29-31-46(50)61)53-59-51(35-19-23-37(24-20-35)54-56-43-14-6-8-16-47(43)62-54)58-52(60-53)36-21-25-38(26-22-36)55-57-44-15-7-9-17-48(44)63-55/h1-38H;1-36H;2*1-32H.
What are the key properties of 2-[6-[4-[6-(12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-12-yl)naphthalen-2-yl]-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[6-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[4-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-(12-phenyl-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-5-yl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole?
2-[6-[4-[6-(12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-12-yl)naphthalen-2-yl]-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[6-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[4-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-(12-phenyl-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-5-yl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole has a molecular weight of 3485.90 g/mol, XLogP of 61.34, 24 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-[4-[6-(12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-12-yl)naphthalen-2-yl]-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[6-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[6-(1,3-benzoxazol-2-yl)naphthalen-2-yl]-1,3,5-triazin-2-yl]naphthalen-2-yl]-1,3-benzoxazole;2-[4-[4-(6-benzo[c]carbazol-7-ylnaphthalen-2-yl)-6-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole;2-[4-[4-[4-(1,3-benzoxazol-2-yl)phenyl]-6-(12-phenyl-12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3(8),4,6,9,14,16,18,20-decaen-5-yl)-1,3,5-triazin-2-yl]phenyl]-1,3-benzoxazole is sourced from PubChem (CID 159183156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).