2,5-bis[9-[4-[4-(4-naphthalen-2-ylphenyl)quinazolin-2-yl]phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis[9-[4-(4-naphthalen-2-ylquinazolin-2-yl)phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis(9-phenylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(3-phenylphenyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis[9-(6-phenyl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis(9-pyridin-3-ylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole

C378H232N44O2S5 — CID 159067503

About 2,5-bis[9-[4-[4-(4-naphthalen-2-ylphenyl)quinazolin-2-yl]phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis[9-[4-(4-naphthalen-2-ylquinazolin-2-yl)phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis(9-phenylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(3-phenylphenyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis[9-(6-phenyl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis(9-pyridin-3-ylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole

2,5-bis[9-[4-[4-(4-naphthalen-2-ylphenyl)quinazolin-2-yl]phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis[9-[4-(4-naphthalen-2-ylquinazolin-2-yl)phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis(9-phenylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(3-phenylphenyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis[9-(6-phenyl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis(9-pyridin-3-ylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole (PubChem CID 159067503) has the molecular formula C378H232N44O2S5 and a molecular weight of 5582.66 g/mol. Its IUPAC name is 2,5-bis[9-[4-[4-(4-naphthalen-2-ylphenyl)quinazolin-2-yl]phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis[9-[4-(4-naphthalen-2-ylquinazolin-2-yl)phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis(9-phenylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(3-phenylphenyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis[9-(6-phenyl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis(9-pyridin-3-ylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole.

Molecular Properties

• Compound Name: 2,5-bis[9-[4-[4-(4-naphthalen-2-ylphenyl)quinazolin-2-yl]phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis[9-[4-(4-naphthalen-2-ylquinazolin-2-yl)phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis(9-phenylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(3-phenylphenyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis[9-(6-phenyl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis(9-pyridin-3-ylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole
• PubChem CID: 159067503
• Molecular Formula: C378H232N44O2S5
• Molecular Weight: 5582.66 g/mol
• Exact Mass: 5577.80
• IUPAC Name: 2,5-bis[9-[4-[4-(4-naphthalen-2-ylphenyl)quinazolin-2-yl]phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis[9-[4-(4-naphthalen-2-ylquinazolin-2-yl)phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis(9-phenylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(3-phenylphenyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis[9-(6-phenyl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis(9-pyridin-3-ylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole
• SMILES: c1ccc(-c2cccc(-n3c4ccccc4c4cccc(-c5nnc(-c6cccc7c8ccccc8n(-c8cccc(-c9ccccc9)c8)c67)s5)c43)c2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cccc(-c5nnc(-c6cccc7c8ccccc8n(-c8cccc(-c9ccccc9)n8)c67)s5)c43)n2)cc1.c1ccc(-n2c3ccccc3c3cccc(-c4nnc(-c5cccc6c7ccccc7n(-c7ccccc7)c56)s4)c32)cc1.c1ccc2cc(-c3ccc(-c4nc(-c5ccc(-n6c7ccccc7c7ccc(-c8nnc(-c9ccc%10c%11ccccc%11n(-c%11ccc(-c%12nc(-c%13ccc(-c%14ccc%15ccccc%15c%14)cc%13)c%13ccccc%13n%12)cc%11)c%10c9)o8)cc76)cc5)nc5ccccc45)cc3)ccc2c1.c1ccc2cc(-c3nc(-c4ccc(-n5c6ccccc6c6ccc(-c7nnc(-c8ccc9c%10ccccc%10n(-c%10ccc(-c%11nc(-c%12ccc%13ccccc%13c%12)c%12ccccc%12n%11)cc%10)c9c8)o7)cc65)cc4)nc4ccccc34)ccc2c1.c1cncc(-c2cccc(-n3c4ccccc4c4cccc(-c5nnc(-c6cccc7c8ccccc8n(-c8cccc(-c9cccnc9)n8)c67)s5)c43)n2)c1.c1cncc(-n2c3ccccc3c3cccc(-c4nnc(-c5cccc6c7ccccc7n(-c7cccnc7)c56)s4)c32)c1
• InChI: InChI=1S/C86H52N8O.C74H44N8O.C50H32N4S.C48H30N6S.C46H28N8S.C38H24N4S.C36H22N6S/c1-3-15-61-49-63(35-29-53(61)13-1)55-25-31-57(32-26-55)81-73-19-5-9-21-75(73)87-83(89-81)59-37-43-67(44-38-59)93-77-23-11-7-17-69(77)71-47-41-65(51-79(71)93)85-91-92-86(95-85)66-42-48-72-70-18-8-12-24-78(70)94(80(72)52-66)68-45-39-60(40-46-68)84-88-76-22-10-6-20-74(76)82(90-84)58-33-27-56(28-34-58)64-36-30-54-14-2-4-16-62(54)50-64;1-3-15-49-41-51(27-25-45(49)13-1)69-61-19-5-9-21-63(61)75-71(77-69)47-29-35-55(36-30-47)81-65-23-11-7-17-57(65)59-39-33-53(43-67(59)81)73-79-80-74(83-73)54-34-40-60-58-18-8-12-24-66(58)82(68(60)44-54)56-37-31-48(32-38-56)72-76-64-22-10-6-20-62(64)70(78-72)52-28-26-46-14-2-4-16-50(46)42-52;1-3-15-33(16-4-1)35-19-11-21-37(31-35)53-45-29-9-7-23-39(45)41-25-13-27-43(47(41)53)49-51-52-50(55-49)44-28-14-26-42-40-24-8-10-30-46(40)54(48(42)44)38-22-12-20-36(32-38)34-17-5-2-6-18-34;1-3-15-31(16-4-1)39-25-13-29-43(49-39)53-41-27-9-7-19-33(41)35-21-11-23-37(45(35)53)47-51-52-48(55-47)38-24-12-22-36-34-20-8-10-28-42(34)54(46(36)38)44-30-14-26-40(50-44)32-17-5-2-6-18-32;1-3-21-39-31(13-1)33-15-5-17-35(43(33)53(39)41-23-7-19-37(49-41)29-11-9-25-47-27-29)45-51-52-46(55-45)36-18-6-16-34-32-14-2-4-22-40(32)54(44(34)36)42-24-8-20-38(50-42)30-12-10-26-48-28-30;1-3-13-25(14-4-1)41-33-23-9-7-17-27(33)29-19-11-21-31(35(29)41)37-39-40-38(43-37)32-22-12-20-30-28-18-8-10-24-34(28)42(36(30)32)26-15-5-2-6-16-26;1-3-17-31-25(11-1)27-13-5-15-29(33(27)41(31)23-9-7-19-37-21-23)35-39-40-36(43-35)30-16-6-14-28-26-12-2-4-18-32(26)42(34(28)30)24-10-8-20-38-22-24/h1-52H;1-44H;1-32H;1-30H;1-28H;1-24H;1-22H
• InChIKey: JZFZNUNEBNCPDI-UHFFFAOYSA-N
• XLogP: 95.74
• TPSA: 482.00 Ų
• H-Bond Acceptors: 51
• Rotatable Bonds: 44
• Heavy Atoms: 429
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	5582.66
LogP ≤ 5	95.74
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	51

Frequently Asked Questions

What is the IUPAC name of 2,5-bis[9-[4-[4-(4-naphthalen-2-ylphenyl)quinazolin-2-yl]phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis[9-[4-(4-naphthalen-2-ylquinazolin-2-yl)phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis(9-phenylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(3-phenylphenyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis[9-(6-phenyl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis(9-pyridin-3-ylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole?

The IUPAC name of 2,5-bis[9-[4-[4-(4-naphthalen-2-ylphenyl)quinazolin-2-yl]phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis[9-[4-(4-naphthalen-2-ylquinazolin-2-yl)phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis(9-phenylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(3-phenylphenyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis[9-(6-phenyl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis(9-pyridin-3-ylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole (CID 159067503) is 2,5-bis[9-[4-[4-(4-naphthalen-2-ylphenyl)quinazolin-2-yl]phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis[9-[4-(4-naphthalen-2-ylquinazolin-2-yl)phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis(9-phenylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(3-phenylphenyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis[9-(6-phenyl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis(9-pyridin-3-ylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole.

What is the SMILES notation for 2,5-bis[9-[4-[4-(4-naphthalen-2-ylphenyl)quinazolin-2-yl]phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis[9-[4-(4-naphthalen-2-ylquinazolin-2-yl)phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis(9-phenylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(3-phenylphenyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis[9-(6-phenyl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis(9-pyridin-3-ylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole?

The canonical SMILES for 2,5-bis[9-[4-[4-(4-naphthalen-2-ylphenyl)quinazolin-2-yl]phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis[9-[4-(4-naphthalen-2-ylquinazolin-2-yl)phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis(9-phenylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(3-phenylphenyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis[9-(6-phenyl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis(9-pyridin-3-ylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole is c1ccc(-c2cccc(-n3c4ccccc4c4cccc(-c5nnc(-c6cccc7c8ccccc8n(-c8cccc(-c9ccccc9)c8)c67)s5)c43)c2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cccc(-c5nnc(-c6cccc7c8ccccc8n(-c8cccc(-c9ccccc9)n8)c67)s5)c43)n2)cc1.c1ccc(-n2c3ccccc3c3cccc(-c4nnc(-c5cccc6c7ccccc7n(-c7ccccc7)c56)s4)c32)cc1.c1ccc2cc(-c3ccc(-c4nc(-c5ccc(-n6c7ccccc7c7ccc(-c8nnc(-c9ccc%10c%11ccccc%11n(-c%11ccc(-c%12nc(-c%13ccc(-c%14ccc%15ccccc%15c%14)cc%13)c%13ccccc%13n%12)cc%11)c%10c9)o8)cc76)cc5)nc5ccccc45)cc3)ccc2c1.c1ccc2cc(-c3nc(-c4ccc(-n5c6ccccc6c6ccc(-c7nnc(-c8ccc9c%10ccccc%10n(-c%10ccc(-c%11nc(-c%12ccc%13ccccc%13c%12)c%12ccccc%12n%11)cc%10)c9c8)o7)cc65)cc4)nc4ccccc34)ccc2c1.c1cncc(-c2cccc(-n3c4ccccc4c4cccc(-c5nnc(-c6cccc7c8ccccc8n(-c8cccc(-c9cccnc9)n8)c67)s5)c43)n2)c1.c1cncc(-n2c3ccccc3c3cccc(-c4nnc(-c5cccc6c7ccccc7n(-c7cccnc7)c56)s4)c32)c1.

What is the InChIKey of 2,5-bis[9-[4-[4-(4-naphthalen-2-ylphenyl)quinazolin-2-yl]phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis[9-[4-(4-naphthalen-2-ylquinazolin-2-yl)phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis(9-phenylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(3-phenylphenyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis[9-(6-phenyl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis(9-pyridin-3-ylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole?

The InChIKey is JZFZNUNEBNCPDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C86H52N8O.C74H44N8O.C50H32N4S.C48H30N6S.C46H28N8S.C38H24N4S.C36H22N6S/c1-3-15-61-49-63(35-29-53(61)13-1)55-25-31-57(32-26-55)81-73-19-5-9-21-75(73)87-83(89-81)59-37-43-67(44-38-59)93-77-23-11-7-17-69(77)71-47-41-65(51-79(71)93)85-91-92-86(95-85)66-42-48-72-70-18-8-12-24-78(70)94(80(72)52-66)68-45-39-60(40-46-68)84-88-76-22-10-6-20-74(76)82(90-84)58-33-27-56(28-34-58)64-36-30-54-14-2-4-16-62(54)50-64;1-3-15-49-41-51(27-25-45(49)13-1)69-61-19-5-9-21-63(61)75-71(77-69)47-29-35-55(36-30-47)81-65-23-11-7-17-57(65)59-39-33-53(43-67(59)81)73-79-80-74(83-73)54-34-40-60-58-18-8-12-24-66(58)82(68(60)44-54)56-37-31-48(32-38-56)72-76-64-22-10-6-20-62(64)70(78-72)52-28-26-46-14-2-4-16-50(46)42-52;1-3-15-33(16-4-1)35-19-11-21-37(31-35)53-45-29-9-7-23-39(45)41-25-13-27-43(47(41)53)49-51-52-50(55-49)44-28-14-26-42-40-24-8-10-30-46(40)54(48(42)44)38-22-12-20-36(32-38)34-17-5-2-6-18-34;1-3-15-31(16-4-1)39-25-13-29-43(49-39)53-41-27-9-7-19-33(41)35-21-11-23-37(45(35)53)47-51-52-48(55-47)38-24-12-22-36-34-20-8-10-28-42(34)54(46(36)38)44-30-14-26-40(50-44)32-17-5-2-6-18-32;1-3-21-39-31(13-1)33-15-5-17-35(43(33)53(39)41-23-7-19-37(49-41)29-11-9-25-47-27-29)45-51-52-46(55-45)36-18-6-16-34-32-14-2-4-22-40(32)54(44(34)36)42-24-8-20-38(50-42)30-12-10-26-48-28-30;1-3-13-25(14-4-1)41-33-23-9-7-17-27(33)29-19-11-21-31(35(29)41)37-39-40-38(43-37)32-22-12-20-30-28-18-8-10-24-34(28)42(36(30)32)26-15-5-2-6-16-26;1-3-17-31-25(11-1)27-13-5-15-29(33(27)41(31)23-9-7-19-37-21-23)35-39-40-36(43-35)30-16-6-14-28-26-12-2-4-18-32(26)42(34(28)30)24-10-8-20-38-22-24/h1-52H;1-44H;1-32H;1-30H;1-28H;1-24H;1-22H.

What are the key properties of 2,5-bis[9-[4-[4-(4-naphthalen-2-ylphenyl)quinazolin-2-yl]phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis[9-[4-(4-naphthalen-2-ylquinazolin-2-yl)phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis(9-phenylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(3-phenylphenyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis[9-(6-phenyl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis(9-pyridin-3-ylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole?

2,5-bis[9-[4-[4-(4-naphthalen-2-ylphenyl)quinazolin-2-yl]phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis[9-[4-(4-naphthalen-2-ylquinazolin-2-yl)phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis(9-phenylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(3-phenylphenyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis[9-(6-phenyl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis(9-pyridin-3-ylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole has a molecular weight of 5582.66 g/mol, XLogP of 95.74, 44 rotatable bonds, 0 hydrogen bond donors, and 51 hydrogen bond acceptors.

Where does this data come from?

All data for 2,5-bis[9-[4-[4-(4-naphthalen-2-ylphenyl)quinazolin-2-yl]phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis[9-[4-(4-naphthalen-2-ylquinazolin-2-yl)phenyl]carbazol-2-yl]-1,3,4-oxadiazole;2,5-bis(9-phenylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(3-phenylphenyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis[9-(6-phenyl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole;2,5-bis(9-pyridin-3-ylcarbazol-1-yl)-1,3,4-thiadiazole;2,5-bis[9-(6-pyridin-3-yl-2-pyridinyl)carbazol-1-yl]-1,3,4-thiadiazole is sourced from PubChem (CID 159067503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).