C386H262N42O2S4 — CID 159607198
2-N,6-N-bis(furan-2-yl)-9,10-diphenyl-2-N,6-N-dipyridin-2-ylanthracene-2,6-diamine;9,10-dinaphthalen-2-yl-2-N,2-N,6-N,6-N-tetrapyridin-2-ylanthracene-2,6-diamine;9,10-dinaphthalen-2-yl-2-N,2-N,6-N,6-N-tetrapyridin-3-ylanthracene-2,6-diamine;9,10-dinaphthalen-2-yl-2-N,2-N,6-N,6-N-tetrapyridin-4-ylanthracene-2,6-diamine;9,10-diphenyl-2-N,6-N-dipyridin-2-yl-2-N,6-N-dipyridin-3-ylanthracene-2,6-diamine;9,10-diphenyl-2-N,6-N-dipyridin-3-yl-2-N,6-N-dipyridin-4-ylanthracene-2,6-diamine;9,10-diphenyl-2-N,6-N-dipyridin-2-yl-2-N,6-N-dithiophen-2-ylanthracene-2,6-diamine;9,10-diphenyl-2-N,6-N-dipyridin-3-yl-2-N,6-N-dithiophen-2-ylanthracene-2,6-diamine (PubChem CID 159607198) has the molecular formula C386H262N42O2S4 and a molecular weight of 5648.90 g/mol. Its IUPAC name is 2-N,6-N-bis(furan-2-yl)-9,10-diphenyl-2-N,6-N-dipyridin-2-ylanthracene-2,6-diamine;9,10-dinaphthalen-2-yl-2-N,2-N,6-N,6-N-tetrapyridin-2-ylanthracene-2,6-diamine;9,10-dinaphthalen-2-yl-2-N,2-N,6-N,6-N-tetrapyridin-3-ylanthracene-2,6-diamine;9,10-dinaphthalen-2-yl-2-N,2-N,6-N,6-N-tetrapyridin-4-ylanthracene-2,6-diamine;9,10-diphenyl-2-N,6-N-dipyridin-2-yl-2-N,6-N-dipyridin-3-ylanthracene-2,6-diamine;9,10-diphenyl-2-N,6-N-dipyridin-3-yl-2-N,6-N-dipyridin-4-ylanthracene-2,6-diamine;9,10-diphenyl-2-N,6-N-dipyridin-2-yl-2-N,6-N-dithiophen-2-ylanthracene-2,6-diamine;9,10-diphenyl-2-N,6-N-dipyridin-3-yl-2-N,6-N-dithiophen-2-ylanthracene-2,6-diamine.
| Compound Name | 2-N,6-N-bis(furan-2-yl)-9,10-diphenyl-2-N,6-N-dipyridin-2-ylanthracene-2,6-diamine;9,10-dinaphthalen-2-yl-2-N,2-N,6-N,6-N-tetrapyridin-2-ylanthracene-2,6-diamine;9,10-dinaphthalen-2-yl-2-N,2-N,6-N,6-N-tetrapyridin-3-ylanthracene-2,6-diamine;9,10-dinaphthalen-2-yl-2-N,2-N,6-N,6-N-tetrapyridin-4-ylanthracene-2,6-diamine;9,10-diphenyl-2-N,6-N-dipyridin-2-yl-2-N,6-N-dipyridin-3-ylanthracene-2,6-diamine;9,10-diphenyl-2-N,6-N-dipyridin-3-yl-2-N,6-N-dipyridin-4-ylanthracene-2,6-diamine;9,10-diphenyl-2-N,6-N-dipyridin-2-yl-2-N,6-N-dithiophen-2-ylanthracene-2,6-diamine;9,10-diphenyl-2-N,6-N-dipyridin-3-yl-2-N,6-N-dithiophen-2-ylanthracene-2,6-diamine |
|---|---|
| PubChem CID | 159607198 |
| Molecular Formula | C386H262N42O2S4 |
| Molecular Weight | 5648.90 g/mol |
| Exact Mass | 5644.06 |
| IUPAC Name | 2-N,6-N-bis(furan-2-yl)-9,10-diphenyl-2-N,6-N-dipyridin-2-ylanthracene-2,6-diamine;9,10-dinaphthalen-2-yl-2-N,2-N,6-N,6-N-tetrapyridin-2-ylanthracene-2,6-diamine;9,10-dinaphthalen-2-yl-2-N,2-N,6-N,6-N-tetrapyridin-3-ylanthracene-2,6-diamine;9,10-dinaphthalen-2-yl-2-N,2-N,6-N,6-N-tetrapyridin-4-ylanthracene-2,6-diamine;9,10-diphenyl-2-N,6-N-dipyridin-2-yl-2-N,6-N-dipyridin-3-ylanthracene-2,6-diamine;9,10-diphenyl-2-N,6-N-dipyridin-3-yl-2-N,6-N-dipyridin-4-ylanthracene-2,6-diamine;9,10-diphenyl-2-N,6-N-dipyridin-2-yl-2-N,6-N-dithiophen-2-ylanthracene-2,6-diamine;9,10-diphenyl-2-N,6-N-dipyridin-3-yl-2-N,6-N-dithiophen-2-ylanthracene-2,6-diamine |
| SMILES | c1ccc(-c2c3ccc(N(c4ccccn4)c4ccco4)cc3c(-c3ccccc3)c3ccc(N(c4ccccn4)c4ccco4)cc23)cc1.c1ccc(-c2c3ccc(N(c4ccccn4)c4cccs4)cc3c(-c3ccccc3)c3ccc(N(c4ccccn4)c4cccs4)cc23)cc1.c1ccc(-c2c3ccc(N(c4cccnc4)c4ccccn4)cc3c(-c3ccccc3)c3ccc(N(c4cccnc4)c4ccccn4)cc23)cc1.c1ccc(-c2c3ccc(N(c4cccnc4)c4cccs4)cc3c(-c3ccccc3)c3ccc(N(c4cccnc4)c4cccs4)cc23)cc1.c1ccc(-c2c3ccc(N(c4ccncc4)c4cccnc4)cc3c(-c3ccccc3)c3ccc(N(c4ccncc4)c4cccnc4)cc23)cc1.c1ccc(N(c2ccc3c(-c4ccc5ccccc5c4)c4cc(N(c5ccccn5)c5ccccn5)ccc4c(-c4ccc5ccccc5c4)c3c2)c2ccccn2)nc1.c1ccc2cc(-c3c4ccc(N(c5ccncc5)c5ccncc5)cc4c(-c4ccc5ccccc5c4)c4ccc(N(c5ccncc5)c5ccncc5)cc34)ccc2c1.c1cncc(N(c2cccnc2)c2ccc3c(-c4ccc5ccccc5c4)c4cc(N(c5cccnc5)c5cccnc5)ccc4c(-c4ccc5ccccc5c4)c3c2)c1 |
| InChI | InChI=1S/3C54H36N6.2C46H32N6.C44H30N4O2.2C44H30N4S2/c1-3-15-39-33-41(23-21-37(39)13-1)53-45-27-25-44(60(51-19-7-11-31-57-51)52-20-8-12-32-58-52)36-48(45)54(42-24-22-38-14-2-4-16-40(38)34-42)46-28-26-43(35-47(46)53)59(49-17-5-9-29-55-49)50-18-6-10-30-56-50;1-3-11-39-29-41(19-17-37(39)9-1)53-49-23-21-44(60(47-15-7-27-57-35-47)48-16-8-28-58-36-48)32-52(49)54(42-20-18-38-10-2-4-12-40(38)30-42)50-24-22-43(31-51(50)53)59(45-13-5-25-55-33-45)46-14-6-26-56-34-46;1-3-7-39-33-41(11-9-37(39)5-1)53-49-15-13-48(60(45-21-29-57-30-22-45)46-23-31-58-32-24-46)36-52(49)54(42-12-10-38-6-2-4-8-40(38)34-42)50-16-14-47(35-51(50)53)59(43-17-25-55-26-18-43)44-19-27-56-28-20-44;1-3-13-33(14-4-1)45-39-23-21-36(52(38-18-12-26-48-32-38)44-20-8-10-28-50-44)30-42(39)46(34-15-5-2-6-16-34)40-24-22-35(29-41(40)45)51(37-17-11-25-47-31-37)43-19-7-9-27-49-43;1-3-9-33(10-4-1)45-41-17-15-38(52(36-21-27-48-28-22-36)40-14-8-24-50-32-40)30-44(41)46(34-11-5-2-6-12-34)42-18-16-37(29-43(42)45)51(35-19-25-47-26-20-35)39-13-7-23-49-31-39;1-3-13-31(14-4-1)43-35-23-21-34(48(42-20-12-28-50-42)40-18-8-10-26-46-40)30-38(35)44(32-15-5-2-6-16-32)36-24-22-33(29-37(36)43)47(41-19-11-27-49-41)39-17-7-9-25-45-39;1-3-11-31(12-4-1)43-37-21-19-34(48(42-18-10-26-50-42)36-16-8-24-46-30-36)28-40(37)44(32-13-5-2-6-14-32)38-22-20-33(27-39(38)43)47(41-17-9-25-49-41)35-15-7-23-45-29-35;1-3-13-31(14-4-1)43-35-23-21-34(48(42-20-12-28-50-42)40-18-8-10-26-46-40)30-38(35)44(32-15-5-2-6-16-32)36-24-22-33(29-37(36)43)47(41-19-11-27-49-41)39-17-7-9-25-45-39/h3*1-36H;2*1-32H;3*1-30H |
| InChIKey | MMFQDTODEMBKSX-UHFFFAOYSA-N |
| XLogP | 104.75 |
| TPSA | 413.26 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 48 |
| Rotatable Bonds | 64 |
| Heavy Atoms | 434 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 5648.90 |
| LogP ≤ 5 | 104.75 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 48 |