7-[2-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]ethynyl]-4-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]selenophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]thiophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole

C298H361N9O3S4Se — CID 157237297

About 7-[2-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]ethynyl]-4-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]selenophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]thiophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole

7-[2-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]ethynyl]-4-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]selenophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]thiophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole (PubChem CID 157237297) has the molecular formula C298H361N9O3S4Se and a molecular weight of 4324.45 g/mol. Its IUPAC name is 7-[2-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]ethynyl]-4-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]selenophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]thiophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole.

Molecular Properties

• Compound Name: 7-[2-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]ethynyl]-4-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]selenophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]thiophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole
• PubChem CID: 157237297
• Molecular Formula: C298H361N9O3S4Se
• Molecular Weight: 4324.45 g/mol
• Exact Mass: 4321.64
• IUPAC Name: 7-[2-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]ethynyl]-4-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]selenophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]thiophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole
• SMILES: CCCCCCCCC(CCCCCC)COc1ccc2c(c1)C(c1ccc(CCCCCC)cc1)(c1ccc(CCCCCC)cc1)c1ccc3c4cccc5c(-c6ccc(-c7ccc(-c8ccc(C)cc8)c8nsnc78)[se]6)cc6c(c54)c4c3c1c-2cc4n6CC(CCCCCC)CCCCCCCC.CCCCCCCCC(CCCCCC)COc1ccc2c(c1)C(c1ccc(CCCCCC)cc1)(c1ccc(CCCCCC)cc1)c1ccc3c4cccc5c(-c6ccc(-c7ccc(-c8ccc(C)cc8)c8nsnc78)s6)cc6c(c54)c4c3c1c-2cc4n6CC(CCCCCC)CCCCCCCC.CCCCCCCCC(CCCCCC)COc1ccc2c(c1)C(c1ccc(CCCCCC)cc1)(c1ccc(CCCCCC)cc1)c1ccc3c4cccc5c(C#Cc6ccc(-c7ccc(C)cc7)c7nsnc67)cc6c(c54)c4c3c1c-2cc4n6CC(CCCCCC)CCCCCCCC
• InChI: InChI=1S/C100H121N3OS2.C100H121N3OSSe.C98H119N3OS/c1-8-14-20-26-28-34-40-73(39-32-24-18-12-5)68-103-89-66-85(92-64-63-91(105-92)84-60-59-79(98-99(84)102-106-101-98)75-51-45-70(7)46-52-75)82-44-36-43-81-83-61-62-87-94-86(67-90(103)97(95(83)94)96(89)93(81)82)80-58-57-78(104-69-74(41-33-25-19-13-6)42-35-29-27-21-15-9-2)65-88(80)100(87,76-53-47-71(48-54-76)37-30-22-16-10-3)77-55-49-72(50-56-77)38-31-23-17-11-4;1-8-14-20-26-28-34-40-73(39-32-24-18-12-5)68-103-89-66-85(92-64-63-91(106-92)84-60-59-79(98-99(84)102-105-101-98)75-51-45-70(7)46-52-75)82-44-36-43-81-83-61-62-87-94-86(67-90(103)97(95(83)94)96(89)93(81)82)80-58-57-78(104-69-74(41-33-25-19-13-6)42-35-29-27-21-15-9-2)65-88(80)100(87,76-53-47-71(48-54-76)37-30-22-16-10-3)77-55-49-72(50-56-77)38-31-23-17-11-4;1-8-14-20-26-28-34-40-73(39-32-24-18-12-5)68-101-89-65-77(54-53-76-55-61-82(97-96(76)99-103-100-97)75-51-45-70(7)46-52-75)81-43-36-44-84-85-63-64-87-92-86(67-90(101)95(93(85)92)94(89)91(81)84)83-62-60-80(102-69-74(41-33-25-19-13-6)42-35-29-27-21-15-9-2)66-88(83)98(87,78-56-47-71(48-57-78)37-30-22-16-10-3)79-58-49-72(50-59-79)38-31-23-17-11-4/h2*36,43-67,73-74H,8-35,37-42,68-69H2,1-7H3;36,43-52,55-67,73-74H,8-35,37-42,68-69H2,1-7H3
• InChIKey: AUUCIEBPZMJWIB-UHFFFAOYSA-N
• XLogP: 90.50
• TPSA: 119.82 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 130
• Heavy Atoms: 315
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4324.45
LogP ≤ 5	90.50
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7-[2-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]ethynyl]-4-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]selenophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]thiophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole?

The IUPAC name of 7-[2-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]ethynyl]-4-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]selenophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]thiophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole (CID 157237297) is 7-[2-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]ethynyl]-4-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]selenophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]thiophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole.

What is the SMILES notation for 7-[2-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]ethynyl]-4-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]selenophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]thiophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole?

The canonical SMILES for 7-[2-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]ethynyl]-4-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]selenophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]thiophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole is CCCCCCCCC(CCCCCC)COc1ccc2c(c1)C(c1ccc(CCCCCC)cc1)(c1ccc(CCCCCC)cc1)c1ccc3c4cccc5c(-c6ccc(-c7ccc(-c8ccc(C)cc8)c8nsnc78)[se]6)cc6c(c54)c4c3c1c-2cc4n6CC(CCCCCC)CCCCCCCC.CCCCCCCCC(CCCCCC)COc1ccc2c(c1)C(c1ccc(CCCCCC)cc1)(c1ccc(CCCCCC)cc1)c1ccc3c4cccc5c(-c6ccc(-c7ccc(-c8ccc(C)cc8)c8nsnc78)s6)cc6c(c54)c4c3c1c-2cc4n6CC(CCCCCC)CCCCCCCC.CCCCCCCCC(CCCCCC)COc1ccc2c(c1)C(c1ccc(CCCCCC)cc1)(c1ccc(CCCCCC)cc1)c1ccc3c4cccc5c(C#Cc6ccc(-c7ccc(C)cc7)c7nsnc67)cc6c(c54)c4c3c1c-2cc4n6CC(CCCCCC)CCCCCCCC.

What is the InChIKey of 7-[2-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]ethynyl]-4-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]selenophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]thiophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole?

The InChIKey is AUUCIEBPZMJWIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C100H121N3OS2.C100H121N3OSSe.C98H119N3OS/c1-8-14-20-26-28-34-40-73(39-32-24-18-12-5)68-103-89-66-85(92-64-63-91(105-92)84-60-59-79(98-99(84)102-106-101-98)75-51-45-70(7)46-52-75)82-44-36-43-81-83-61-62-87-94-86(67-90(103)97(95(83)94)96(89)93(81)82)80-58-57-78(104-69-74(41-33-25-19-13-6)42-35-29-27-21-15-9-2)65-88(80)100(87,76-53-47-71(48-54-76)37-30-22-16-10-3)77-55-49-72(50-56-77)38-31-23-17-11-4;1-8-14-20-26-28-34-40-73(39-32-24-18-12-5)68-103-89-66-85(92-64-63-91(106-92)84-60-59-79(98-99(84)102-105-101-98)75-51-45-70(7)46-52-75)82-44-36-43-81-83-61-62-87-94-86(67-90(103)97(95(83)94)96(89)93(81)82)80-58-57-78(104-69-74(41-33-25-19-13-6)42-35-29-27-21-15-9-2)65-88(80)100(87,76-53-47-71(48-54-76)37-30-22-16-10-3)77-55-49-72(50-56-77)38-31-23-17-11-4;1-8-14-20-26-28-34-40-73(39-32-24-18-12-5)68-101-89-65-77(54-53-76-55-61-82(97-96(76)99-103-100-97)75-51-45-70(7)46-52-75)81-43-36-44-84-85-63-64-87-92-86(67-90(101)95(93(85)92)94(89)91(81)84)83-62-60-80(102-69-74(41-33-25-19-13-6)42-35-29-27-21-15-9-2)66-88(83)98(87,78-56-47-71(48-57-78)37-30-22-16-10-3)79-58-49-72(50-59-79)38-31-23-17-11-4/h2*36,43-67,73-74H,8-35,37-42,68-69H2,1-7H3;36,43-52,55-67,73-74H,8-35,37-42,68-69H2,1-7H3.

What are the key properties of 7-[2-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]ethynyl]-4-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]selenophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]thiophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole?

7-[2-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]ethynyl]-4-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]selenophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]thiophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole has a molecular weight of 4324.45 g/mol, XLogP of 90.50, 130 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 7-[2-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]ethynyl]-4-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]selenophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole;4-[5-[20-(2-hexyldecoxy)-13-(2-hexyldecyl)-23,23-bis(4-hexylphenyl)-13-azaoctacyclo[14.11.1.02,14.03,12.04,9.05,27.017,22.024,28]octacosa-1(27),2(14),3(12),4,6,8,10,15,17(22),18,20,24(28),25-tridecaen-10-yl]thiophen-2-yl]-7-(4-methylphenyl)-2,1,3-benzothiadiazole is sourced from PubChem (CID 157237297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).