15-[2-(9-naphthalen-2-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-(9-phenanthren-9-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(6-phenylnaphthalen-2-yl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene

C254H150N20O5 — CID 157338473

IUPAC15-[2-(9-naphthalen-2-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-(9-phenanthren-9-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(6-phenylnaphthalen-2-yl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7nc8c9c(cccc9n7)Oc7ccccc7-8)c6c5)ccc43)cc2)cc1.c1ccc(-c2ccc3cc(-n4c5ccccc5c5cc(-c6ccc7c8ccccc8n(-c8nc9c%10c(cccc%10n8)Oc8ccccc8-9)c7c6)ccc54)ccc3c2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7nc8c9c(cccc9n7)Oc7ccccc7-8)c6c5)ccc43)c2)cc1.c1ccc2c(c1)Oc1cccc3nc(-n4c5ccccc5c5ccc(-c6ccc7c(c6)c6ccccc6n7-c6cc7ccccc7c7ccccc67)cc54)nc-2c13.c1ccc2c(c1)Oc1cccc3nc(-n4c5ccccc5c5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccc7ccccc7c6)cc54)nc-2c13
InChIInChI=1S/C54H32N4O.C52H30N4O.2C50H30N4O.C48H28N4O/c1-2-11-33(12-3-1)34-21-22-36-30-39(26-23-35(36)29-34)57-46-17-7-5-14-41(46)44-31-37(25-28-48(44)57)38-24-27-42-40-13-4-8-18-47(40)58(49(42)32-38)54-55-45-16-10-20-51-52(45)53(56-54)43-15-6-9-19-50(43)59-51;1-2-13-34-33(12-1)30-46(36-15-4-3-14-35(34)36)55-43-20-8-6-17-38(43)41-28-31(25-27-45(41)55)32-24-26-39-37-16-5-9-21-44(37)56(47(39)29-32)52-53-42-19-11-23-49-50(42)51(54-52)40-18-7-10-22-48(40)57-49;1-2-12-31(13-3-1)32-14-10-15-35(28-32)53-42-20-7-5-17-37(42)40-29-33(25-27-44(40)53)34-24-26-38-36-16-4-8-21-43(36)54(45(38)30-34)50-51-41-19-11-23-47-48(41)49(52-50)39-18-6-9-22-46(39)55-47;1-2-11-31(12-3-1)32-21-25-35(26-22-32)53-42-17-7-5-14-37(42)40-29-33(24-28-44(40)53)34-23-27-38-36-13-4-8-18-43(36)54(45(38)30-34)50-51-41-16-10-20-47-48(41)49(52-50)39-15-6-9-19-46(39)55-47;1-2-11-30-26-33(23-20-29(30)10-1)51-40-16-6-4-13-35(40)38-27-31(22-25-42(38)51)32-21-24-36-34-12-3-7-17-41(34)52(43(36)28-32)48-49-39-15-9-19-45-46(39)47(50-48)37-14-5-8-18-44(37)53-45/h1-32H;1-30H;2*1-30H;1-28H
InChIKeyBGCRKINKAMMYBP-UHFFFAOYSA-N
MW3562.13 g/mol
LogP65.93
Rot. Bonds18

About 15-[2-(9-naphthalen-2-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-(9-phenanthren-9-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(6-phenylnaphthalen-2-yl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene

15-[2-(9-naphthalen-2-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-(9-phenanthren-9-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(6-phenylnaphthalen-2-yl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene (PubChem CID 157338473) has the molecular formula C254H150N20O5 and a molecular weight of 3562.13 g/mol. Its IUPAC name is 15-[2-(9-naphthalen-2-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-(9-phenanthren-9-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(6-phenylnaphthalen-2-yl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene.

Molecular Properties

Compound Name15-[2-(9-naphthalen-2-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-(9-phenanthren-9-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(6-phenylnaphthalen-2-yl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene
PubChem CID157338473
Molecular FormulaC254H150N20O5
Molecular Weight3562.13 g/mol
Exact Mass3559.21
IUPAC Name15-[2-(9-naphthalen-2-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-(9-phenanthren-9-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(6-phenylnaphthalen-2-yl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7nc8c9c(cccc9n7)Oc7ccccc7-8)c6c5)ccc43)cc2)cc1.c1ccc(-c2ccc3cc(-n4c5ccccc5c5cc(-c6ccc7c8ccccc8n(-c8nc9c%10c(cccc%10n8)Oc8ccccc8-9)c7c6)ccc54)ccc3c2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7nc8c9c(cccc9n7)Oc7ccccc7-8)c6c5)ccc43)c2)cc1.c1ccc2c(c1)Oc1cccc3nc(-n4c5ccccc5c5ccc(-c6ccc7c(c6)c6ccccc6n7-c6cc7ccccc7c7ccccc67)cc54)nc-2c13.c1ccc2c(c1)Oc1cccc3nc(-n4c5ccccc5c5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccc7ccccc7c6)cc54)nc-2c13
InChIInChI=1S/C54H32N4O.C52H30N4O.2C50H30N4O.C48H28N4O/c1-2-11-33(12-3-1)34-21-22-36-30-39(26-23-35(36)29-34)57-46-17-7-5-14-41(46)44-31-37(25-28-48(44)57)38-24-27-42-40-13-4-8-18-47(40)58(49(42)32-38)54-55-45-16-10-20-51-52(45)53(56-54)43-15-6-9-19-50(43)59-51;1-2-13-34-33(12-1)30-46(36-15-4-3-14-35(34)36)55-43-20-8-6-17-38(43)41-28-31(25-27-45(41)55)32-24-26-39-37-16-5-9-21-44(37)56(47(39)29-32)52-53-42-19-11-23-49-50(42)51(54-52)40-18-7-10-22-48(40)57-49;1-2-12-31(13-3-1)32-14-10-15-35(28-32)53-42-20-7-5-17-37(42)40-29-33(25-27-44(40)53)34-24-26-38-36-16-4-8-21-43(36)54(45(38)30-34)50-51-41-19-11-23-47-48(41)49(52-50)39-18-6-9-22-46(39)55-47;1-2-11-31(12-3-1)32-21-25-35(26-22-32)53-42-17-7-5-14-37(42)40-29-33(24-28-44(40)53)34-23-27-38-36-13-4-8-18-43(36)54(45(38)30-34)50-51-41-16-10-20-47-48(41)49(52-50)39-15-6-9-19-46(39)55-47;1-2-11-30-26-33(23-20-29(30)10-1)51-40-16-6-4-13-35(40)38-27-31(22-25-42(38)51)32-21-24-36-34-12-3-7-17-41(34)52(43(36)28-32)48-49-39-15-9-19-45-46(39)47(50-48)37-14-5-8-18-44(37)53-45/h1-32H;1-30H;2*1-30H;1-28H
InChIKeyBGCRKINKAMMYBP-UHFFFAOYSA-N
XLogP65.93
TPSA224.35 Ų
H-Bond Donors
H-Bond Acceptors25
Rotatable Bonds18
Heavy Atoms279
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003562.13
LogP ≤ 565.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

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

Analyze 15-[2-(9-naphthalen-2-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-(9-phenanthren-9-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(6-phenylnaphthalen-2-yl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 15-[2-(9-naphthalen-2-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-(9-phenanthren-9-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(6-phenylnaphthalen-2-yl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene?
The IUPAC name of 15-[2-(9-naphthalen-2-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-(9-phenanthren-9-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(6-phenylnaphthalen-2-yl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene (CID 157338473) is 15-[2-(9-naphthalen-2-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-(9-phenanthren-9-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(6-phenylnaphthalen-2-yl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene.
What is the SMILES notation for 15-[2-(9-naphthalen-2-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-(9-phenanthren-9-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(6-phenylnaphthalen-2-yl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene?
The canonical SMILES for 15-[2-(9-naphthalen-2-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-(9-phenanthren-9-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(6-phenylnaphthalen-2-yl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene is c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7nc8c9c(cccc9n7)Oc7ccccc7-8)c6c5)ccc43)cc2)cc1.c1ccc(-c2ccc3cc(-n4c5ccccc5c5cc(-c6ccc7c8ccccc8n(-c8nc9c%10c(cccc%10n8)Oc8ccccc8-9)c7c6)ccc54)ccc3c2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7nc8c9c(cccc9n7)Oc7ccccc7-8)c6c5)ccc43)c2)cc1.c1ccc2c(c1)Oc1cccc3nc(-n4c5ccccc5c5ccc(-c6ccc7c(c6)c6ccccc6n7-c6cc7ccccc7c7ccccc67)cc54)nc-2c13.c1ccc2c(c1)Oc1cccc3nc(-n4c5ccccc5c5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccc7ccccc7c6)cc54)nc-2c13.
What is the InChIKey of 15-[2-(9-naphthalen-2-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-(9-phenanthren-9-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(6-phenylnaphthalen-2-yl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene?
The InChIKey is BGCRKINKAMMYBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H32N4O.C52H30N4O.2C50H30N4O.C48H28N4O/c1-2-11-33(12-3-1)34-21-22-36-30-39(26-23-35(36)29-34)57-46-17-7-5-14-41(46)44-31-37(25-28-48(44)57)38-24-27-42-40-13-4-8-18-47(40)58(49(42)32-38)54-55-45-16-10-20-51-52(45)53(56-54)43-15-6-9-19-50(43)59-51;1-2-13-34-33(12-1)30-46(36-15-4-3-14-35(34)36)55-43-20-8-6-17-38(43)41-28-31(25-27-45(41)55)32-24-26-39-37-16-5-9-21-44(37)56(47(39)29-32)52-53-42-19-11-23-49-50(42)51(54-52)40-18-7-10-22-48(40)57-49;1-2-12-31(13-3-1)32-14-10-15-35(28-32)53-42-20-7-5-17-37(42)40-29-33(25-27-44(40)53)34-24-26-38-36-16-4-8-21-43(36)54(45(38)30-34)50-51-41-19-11-23-47-48(41)49(52-50)39-18-6-9-22-46(39)55-47;1-2-11-31(12-3-1)32-21-25-35(26-22-32)53-42-17-7-5-14-37(42)40-29-33(24-28-44(40)53)34-23-27-38-36-13-4-8-18-43(36)54(45(38)30-34)50-51-41-16-10-20-47-48(41)49(52-50)39-15-6-9-19-46(39)55-47;1-2-11-30-26-33(23-20-29(30)10-1)51-40-16-6-4-13-35(40)38-27-31(22-25-42(38)51)32-21-24-36-34-12-3-7-17-41(34)52(43(36)28-32)48-49-39-15-9-19-45-46(39)47(50-48)37-14-5-8-18-44(37)53-45/h1-32H;1-30H;2*1-30H;1-28H.
What are the key properties of 15-[2-(9-naphthalen-2-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-(9-phenanthren-9-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(6-phenylnaphthalen-2-yl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene?
15-[2-(9-naphthalen-2-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-(9-phenanthren-9-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(6-phenylnaphthalen-2-yl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene has a molecular weight of 3562.13 g/mol, XLogP of 65.93, 18 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 15-[2-(9-naphthalen-2-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-(9-phenanthren-9-ylcarbazol-3-yl)carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(6-phenylnaphthalen-2-yl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene;15-[2-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]-8-oxa-14,16-diazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17),14-octaene is sourced from PubChem (CID 157338473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).