C160H103N5 — CID 159195289
5-naphthalen-2-yl-11-phenyl-2-(9-phenylcarbazol-3-yl)-11H-indeno[1,2-b]carbazole;9-naphthalen-2-yl-14-phenyl-5-(9-phenyl-9H-fluoren-3-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;5-naphthalen-2-yl-7-phenyl-2-(9-phenyl-9H-fluoren-3-yl)-7H-indeno[2,1-b]carbazole (PubChem CID 159195289) has the molecular formula C160H103N5 and a molecular weight of 2095.62 g/mol. Its IUPAC name is 5-naphthalen-2-yl-11-phenyl-2-(9-phenylcarbazol-3-yl)-11H-indeno[1,2-b]carbazole;9-naphthalen-2-yl-14-phenyl-5-(9-phenyl-9H-fluoren-3-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;5-naphthalen-2-yl-7-phenyl-2-(9-phenyl-9H-fluoren-3-yl)-7H-indeno[2,1-b]carbazole.
| Compound Name | 5-naphthalen-2-yl-11-phenyl-2-(9-phenylcarbazol-3-yl)-11H-indeno[1,2-b]carbazole;9-naphthalen-2-yl-14-phenyl-5-(9-phenyl-9H-fluoren-3-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;5-naphthalen-2-yl-7-phenyl-2-(9-phenyl-9H-fluoren-3-yl)-7H-indeno[2,1-b]carbazole |
|---|---|
| PubChem CID | 159195289 |
| Molecular Formula | C160H103N5 |
| Molecular Weight | 2095.62 g/mol |
| Exact Mass | 2093.82 |
| IUPAC Name | 5-naphthalen-2-yl-11-phenyl-2-(9-phenylcarbazol-3-yl)-11H-indeno[1,2-b]carbazole;9-naphthalen-2-yl-14-phenyl-5-(9-phenyl-9H-fluoren-3-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;5-naphthalen-2-yl-7-phenyl-2-(9-phenyl-9H-fluoren-3-yl)-7H-indeno[2,1-b]carbazole |
| SMILES | c1ccc(C2c3ccccc3-c3cc(-c4ccc5c(c4)c4c6c7ccccc7n(-c7ccccc7)c6ccc4n5-c4ccc5ccccc5c4)ccc32)cc1.c1ccc(C2c3ccccc3-c3cc(-c4ccc5c(c4)c4cc6c(cc4n5-c4ccc5ccccc5c4)C(c4ccccc4)c4ccccc4-6)ccc32)cc1.c1ccc(C2c3ccccc3-c3cc4c(cc32)c2cc(-c3ccc5c(c3)c3ccccc3n5-c3ccccc3)ccc2n4-c2ccc3ccccc3c2)cc1 |
| InChI | InChI=1S/C54H35N.2C53H34N2/c1-3-14-35(15-4-1)53-43-21-11-9-19-41(43)46-30-38(24-27-45(46)53)39-25-28-51-48(31-39)49-32-47-42-20-10-12-22-44(42)54(36-16-5-2-6-17-36)50(47)33-52(49)55(51)40-26-23-34-13-7-8-18-37(34)29-40;1-3-14-35(15-4-1)53-43-21-10-9-19-41(43)44-33-52-47(32-48(44)53)46-31-38(25-28-51(46)55(52)40-26-23-34-13-7-8-16-36(34)29-40)37-24-27-50-45(30-37)42-20-11-12-22-49(42)54(50)39-17-5-2-6-18-39;1-3-14-35(15-4-1)51-42-20-10-9-19-41(42)45-32-37(24-27-43(45)51)38-25-28-48-46(33-38)53-50(55(48)40-26-23-34-13-7-8-16-36(34)31-40)30-29-49-52(53)44-21-11-12-22-47(44)54(49)39-17-5-2-6-18-39/h1-33,53-54H;1-33,53H;1-33,51H |
| InChIKey | KOOUZHTXNAIKQK-UHFFFAOYSA-N |
| XLogP | 41.65 |
| TPSA | 24.65 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 165 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2095.62 |
| LogP ≤ 5 | 41.65 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 5 |