C223H146N8O2S — CID 159943101
N-dibenzofuran-3-yl-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]dibenzofuran-3-amine;N-naphthalen-2-yl-9,9-diphenyl-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]fluoren-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]dibenzothiophen-4-amine;4-phenyl-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]-N-(4-phenylphenyl)aniline (PubChem CID 159943101) has the molecular formula C223H146N8O2S and a molecular weight of 3001.74 g/mol. Its IUPAC name is N-dibenzofuran-3-yl-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]dibenzofuran-3-amine;N-naphthalen-2-yl-9,9-diphenyl-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]fluoren-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]dibenzothiophen-4-amine;4-phenyl-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]-N-(4-phenylphenyl)aniline.
| Compound Name | N-dibenzofuran-3-yl-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]dibenzofuran-3-amine;N-naphthalen-2-yl-9,9-diphenyl-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]fluoren-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]dibenzothiophen-4-amine;4-phenyl-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]-N-(4-phenylphenyl)aniline |
|---|---|
| PubChem CID | 159943101 |
| Molecular Formula | C223H146N8O2S |
| Molecular Weight | 3001.74 g/mol |
| Exact Mass | 2999.13 |
| IUPAC Name | N-dibenzofuran-3-yl-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]dibenzofuran-3-amine;N-naphthalen-2-yl-9,9-diphenyl-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]fluoren-2-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]dibenzothiophen-4-amine;4-phenyl-N-[4-(12-phenylnaphtho[1,2-b]indolizin-4-yl)phenyl]-N-(4-phenylphenyl)aniline |
| SMILES | c1ccc(-c2c3c4cccc(-c5ccc(N(c6ccc(-c7cccc8ccccc78)cc6)c6cccc7c6sc6ccccc67)cc5)c4ccc3n3ccccc23)cc1.c1ccc(-c2c3c4cccc(-c5ccc(N(c6ccc7c(c6)C(c6ccccc6)(c6ccccc6)c6ccccc6-7)c6ccc7ccccc7c6)cc5)c4ccc3n3ccccc23)cc1.c1ccc(-c2c3c4cccc(-c5ccc(N(c6ccc7c(c6)oc6ccccc67)c6ccc7c(c6)oc6ccccc67)cc5)c4ccc3n3ccccc23)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc5c4ccc4c5c(-c5ccccc5)c5ccccn54)cc3)cc2)cc1 |
| InChI | InChI=1S/C63H42N2.C56H36N2S.C52H32N2O2.C52H36N2/c1-4-18-45(19-5-1)61-59-29-14-15-40-64(59)60-39-38-53-52(26-16-27-56(53)62(60)61)44-31-33-49(34-32-44)65(50-35-30-43-17-10-11-20-46(43)41-50)51-36-37-55-54-25-12-13-28-57(54)63(58(55)42-51,47-21-6-2-7-22-47)48-23-8-3-9-24-48;1-2-14-40(15-3-1)54-50-23-8-9-36-57(50)51-35-34-46-45(20-11-21-48(46)55(51)54)39-28-32-42(33-29-39)58(52-24-12-22-49-47-18-6-7-25-53(47)59-56(49)52)41-30-26-38(27-31-41)44-19-10-16-37-13-4-5-17-43(37)44;1-2-11-34(12-3-1)51-45-17-8-9-30-53(45)46-29-28-39-38(15-10-16-44(39)52(46)51)33-20-22-35(23-21-33)54(36-24-26-42-40-13-4-6-18-47(40)55-49(42)31-36)37-25-27-43-41-14-5-7-19-48(41)56-50(43)32-37;1-4-13-37(14-5-1)39-22-28-43(29-23-39)54(44-30-24-40(25-31-44)38-15-6-2-7-16-38)45-32-26-41(27-33-45)46-19-12-20-48-47(46)34-35-50-52(48)51(42-17-8-3-9-18-42)49-21-10-11-36-53(49)50/h1-42H;1-36H;1-32H;1-36H |
| InChIKey | OBDHGWCVYSSZEU-UHFFFAOYSA-N |
| XLogP | 62.04 |
| TPSA | 56.88 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 11 |
| Rotatable Bonds | 25 |
| Heavy Atoms | 234 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3001.74 |
| LogP ≤ 5 | 62.04 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 11 |