C132H80N8O8Te4 — CID 163760623
(2E)-2-[[5-(9H-acridin-10-yl)tellurophen-2-yl]methylidene]cyclopenta[a]naphthalene-1,3-dione;2-[[5-(9H-acridin-10-yl)tellurophen-2-yl]methylidene]cyclopenta[l]phenanthrene-1,3-dione;2-[[5-(5-phenylpyrido[2,3-b]quinoxalin-10-yl)tellurophen-2-yl]methylidene]cyclopenta[b]naphthalene-1,3-dione;2-[[5-(5-phenylpyrido[2,3-b]quinoxalin-10-yl)tellurophen-2-yl]methylidene]indene-1,3-dione (PubChem CID 163760623) has the molecular formula C132H80N8O8Te4 and a molecular weight of 2416.54 g/mol. Its IUPAC name is (2E)-2-[[5-(9H-acridin-10-yl)tellurophen-2-yl]methylidene]cyclopenta[a]naphthalene-1,3-dione;2-[[5-(9H-acridin-10-yl)tellurophen-2-yl]methylidene]cyclopenta[l]phenanthrene-1,3-dione;2-[[5-(5-phenylpyrido[2,3-b]quinoxalin-10-yl)tellurophen-2-yl]methylidene]cyclopenta[b]naphthalene-1,3-dione;2-[[5-(5-phenylpyrido[2,3-b]quinoxalin-10-yl)tellurophen-2-yl]methylidene]indene-1,3-dione.
| Compound Name | (2E)-2-[[5-(9H-acridin-10-yl)tellurophen-2-yl]methylidene]cyclopenta[a]naphthalene-1,3-dione;2-[[5-(9H-acridin-10-yl)tellurophen-2-yl]methylidene]cyclopenta[l]phenanthrene-1,3-dione;2-[[5-(5-phenylpyrido[2,3-b]quinoxalin-10-yl)tellurophen-2-yl]methylidene]cyclopenta[b]naphthalene-1,3-dione;2-[[5-(5-phenylpyrido[2,3-b]quinoxalin-10-yl)tellurophen-2-yl]methylidene]indene-1,3-dione |
|---|---|
| PubChem CID | 163760623 |
| Molecular Formula | C132H80N8O8Te4 |
| Molecular Weight | 2416.54 g/mol |
| Exact Mass | 2424.23 |
| IUPAC Name | (2E)-2-[[5-(9H-acridin-10-yl)tellurophen-2-yl]methylidene]cyclopenta[a]naphthalene-1,3-dione;2-[[5-(9H-acridin-10-yl)tellurophen-2-yl]methylidene]cyclopenta[l]phenanthrene-1,3-dione;2-[[5-(5-phenylpyrido[2,3-b]quinoxalin-10-yl)tellurophen-2-yl]methylidene]cyclopenta[b]naphthalene-1,3-dione;2-[[5-(5-phenylpyrido[2,3-b]quinoxalin-10-yl)tellurophen-2-yl]methylidene]indene-1,3-dione |
| SMILES | O=C1/C(=C\c2ccc(N3c4ccccc4Cc4ccccc43)[te]2)C(=O)c2c1ccc1ccccc21.O=C1C(=Cc2ccc(N3c4ccccc4Cc4ccccc43)[te]2)C(=O)c2c1c1ccccc1c1ccccc21.O=C1C(=Cc2ccc(N3c4ccccc4N(c4ccccc4)c4cccnc43)[te]2)C(=O)c2cc3ccccc3cc21.O=C1C(=Cc2ccc(N3c4ccccc4N(c4ccccc4)c4cccnc43)[te]2)C(=O)c2ccccc21 |
| InChI | InChI=1S/C35H21N3O2Te.C35H21NO2Te.C31H19N3O2Te.C31H19NO2Te/c39-33-26-19-22-9-4-5-10-23(22)20-27(26)34(40)28(33)21-25-16-17-32(41-25)38-30-14-7-6-13-29(30)37(24-11-2-1-3-12-24)31-15-8-18-36-35(31)38;37-34-28(35(38)33-27-14-6-4-12-25(27)24-11-3-5-13-26(24)32(33)34)20-23-17-18-31(39-23)36-29-15-7-1-9-21(29)19-22-10-2-8-16-30(22)36;35-29-22-11-4-5-12-23(22)30(36)24(29)19-21-16-17-28(37-21)34-26-14-7-6-13-25(26)33(20-9-2-1-3-10-20)27-15-8-18-32-31(27)34;33-30-24-15-13-19-7-1-4-10-23(19)29(24)31(34)25(30)18-22-14-16-28(35-22)32-26-11-5-2-8-20(26)17-21-9-3-6-12-27(21)32/h1-21H;1-18,20H,19H2;1-19H;1-16,18H,17H2/b;;;25-18+ |
| InChIKey | LXWFBMUSOKLDPW-PIRUORJBSA-N |
| XLogP | 29.48 |
| TPSA | 181.78 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 16 |
| Rotatable Bonds | 10 |
| Heavy Atoms | 152 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2416.54 |
| LogP ≤ 5 | 29.48 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 16 |
| Structural Alerts | {'alert_name': 'ene_five_one_A(55)', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_4', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'} |
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