C379H396N50O56 — CID 162262035
4-[4-[[4-[[2-methyl-4-[[2-methyl-4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenoxy]butyl prop-2-enoate;4-[4-[[4-[[2-methyl-4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenoxy]butyl prop-2-enoate;4-[4-[4-[[4-[[2-methyl-4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenyl]phenoxy]butyl prop-2-enoate;4-[4-[[4-[[2-methyl-4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]methylideneamino]phenyl]diazenyl]phenyl]iminomethyl]phenoxy]butyl prop-2-enoate;[4-[4-[[4-[methyl(4-prop-2-enoyloxybutyl)amino]phenyl]diazenyl]benzoyl]oxyphenyl] 4-[[4-[methyl(4-prop-2-enoyloxybutyl)amino]phenyl]diazenyl]benzoate;6-[4-[[4-[[2-methyl-4-[[4-(6-prop-2-enoyloxyhexoxy)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenoxy]hexyl prop-2-enoate;8-[4-[[4-[[2-methyl-4-[[4-(8-prop-2-enoyloxyoctoxy)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenoxy]octyl prop-2-enoate;4-[4-[[4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]diazenyl]phenyl]diazenyl]phenoxy]butyl prop-2-enoate;4-[4-[[4-[4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]diazenyl]phenyl]phenyl]diazenyl]phenoxy]butyl prop-2-enoate (PubChem CID 162262035) has the molecular formula C379H396N50O56 and a molecular weight of 6547.63 g/mol. Its IUPAC name is 4-[4-[[4-[[2-methyl-4-[[2-methyl-4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenoxy]butyl prop-2-enoate;4-[4-[[4-[[2-methyl-4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenoxy]butyl prop-2-enoate;4-[4-[4-[[4-[[2-methyl-4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenyl]phenoxy]butyl prop-2-enoate;4-[4-[[4-[[2-methyl-4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]methylideneamino]phenyl]diazenyl]phenyl]iminomethyl]phenoxy]butyl prop-2-enoate;[4-[4-[[4-[methyl(4-prop-2-enoyloxybutyl)amino]phenyl]diazenyl]benzoyl]oxyphenyl] 4-[[4-[methyl(4-prop-2-enoyloxybutyl)amino]phenyl]diazenyl]benzoate;6-[4-[[4-[[2-methyl-4-[[4-(6-prop-2-enoyloxyhexoxy)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenoxy]hexyl prop-2-enoate;8-[4-[[4-[[2-methyl-4-[[4-(8-prop-2-enoyloxyoctoxy)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenoxy]octyl prop-2-enoate;4-[4-[[4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]diazenyl]phenyl]diazenyl]phenoxy]butyl prop-2-enoate;4-[4-[[4-[4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]diazenyl]phenyl]phenyl]diazenyl]phenoxy]butyl prop-2-enoate.
| Compound Name | 4-[4-[[4-[[2-methyl-4-[[2-methyl-4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenoxy]butyl prop-2-enoate;4-[4-[[4-[[2-methyl-4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenoxy]butyl prop-2-enoate;4-[4-[4-[[4-[[2-methyl-4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenyl]phenoxy]butyl prop-2-enoate;4-[4-[[4-[[2-methyl-4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]methylideneamino]phenyl]diazenyl]phenyl]iminomethyl]phenoxy]butyl prop-2-enoate;[4-[4-[[4-[methyl(4-prop-2-enoyloxybutyl)amino]phenyl]diazenyl]benzoyl]oxyphenyl] 4-[[4-[methyl(4-prop-2-enoyloxybutyl)amino]phenyl]diazenyl]benzoate;6-[4-[[4-[[2-methyl-4-[[4-(6-prop-2-enoyloxyhexoxy)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenoxy]hexyl prop-2-enoate;8-[4-[[4-[[2-methyl-4-[[4-(8-prop-2-enoyloxyoctoxy)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenoxy]octyl prop-2-enoate;4-[4-[[4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]diazenyl]phenyl]diazenyl]phenoxy]butyl prop-2-enoate;4-[4-[[4-[4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]diazenyl]phenyl]phenyl]diazenyl]phenoxy]butyl prop-2-enoate |
|---|---|
| PubChem CID | 162262035 |
| Molecular Formula | C379H396N50O56 |
| Molecular Weight | 6547.63 g/mol |
| Exact Mass | 6542.97 |
| IUPAC Name | 4-[4-[[4-[[2-methyl-4-[[2-methyl-4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenoxy]butyl prop-2-enoate;4-[4-[[4-[[2-methyl-4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenoxy]butyl prop-2-enoate;4-[4-[4-[[4-[[2-methyl-4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenyl]phenoxy]butyl prop-2-enoate;4-[4-[[4-[[2-methyl-4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]methylideneamino]phenyl]diazenyl]phenyl]iminomethyl]phenoxy]butyl prop-2-enoate;[4-[4-[[4-[methyl(4-prop-2-enoyloxybutyl)amino]phenyl]diazenyl]benzoyl]oxyphenyl] 4-[[4-[methyl(4-prop-2-enoyloxybutyl)amino]phenyl]diazenyl]benzoate;6-[4-[[4-[[2-methyl-4-[[4-(6-prop-2-enoyloxyhexoxy)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenoxy]hexyl prop-2-enoate;8-[4-[[4-[[2-methyl-4-[[4-(8-prop-2-enoyloxyoctoxy)phenyl]diazenyl]phenyl]diazenyl]phenyl]diazenyl]phenoxy]octyl prop-2-enoate;4-[4-[[4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]diazenyl]phenyl]diazenyl]phenoxy]butyl prop-2-enoate;4-[4-[[4-[4-[[4-(4-prop-2-enoyloxybutoxy)phenyl]diazenyl]phenyl]phenyl]diazenyl]phenoxy]butyl prop-2-enoate |
| SMILES | C=CC(=O)OCCCCCCCCOc1ccc(/N=N/c2ccc(/N=N/c3ccc(/N=N/c4ccc(OCCCCCCCCOC(=O)C=C)cc4)cc3C)cc2)cc1.C=CC(=O)OCCCCCCOc1ccc(/N=N/c2ccc(/N=N/c3ccc(/N=N/c4ccc(OCCCCCCOC(=O)C=C)cc4)cc3C)cc2)cc1.C=CC(=O)OCCCCN(C)c1ccc(/N=N/c2ccc(C(=O)Oc3ccc(OC(=O)c4ccc(/N=N/c5ccc(N(C)CCCCOC(=O)C=C)cc5)cc4)cc3)cc2)cc1.C=CC(=O)OCCCCOc1ccc(/C=N/c2ccc(/N=N/c3ccc(/N=C/c4ccc(OCCCCOC(=O)C=C)cc4)cc3C)cc2)cc1.C=CC(=O)OCCCCOc1ccc(/N=N/c2ccc(-c3ccc(/N=N/c4ccc(OCCCCOC(=O)C=C)cc4)cc3)cc2)cc1.C=CC(=O)OCCCCOc1ccc(/N=N/c2ccc(/N=N/c3ccc(/N=N/c4ccc(-c5ccc(OCCCCOC(=O)C=C)cc5)cc4)cc3)c(C)c2)cc1.C=CC(=O)OCCCCOc1ccc(/N=N/c2ccc(/N=N/c3ccc(/N=N/c4ccc(/N=N/c5ccc(OCCCCOC(=O)C=C)cc5)cc4C)cc3C)cc2)cc1.C=CC(=O)OCCCCOc1ccc(/N=N/c2ccc(/N=N/c3ccc(/N=N/c4ccc(OCCCCOC(=O)C=C)cc4)cc3C)cc2)cc1.C=CC(=O)OCCCCOc1ccc(/N=N/c2ccc(/N=N/c3ccc(OCCCCOC(=O)C=C)cc3)cc2)cc1 |
| InChI | InChI=1S/C48H48N6O8.C47H56N6O6.C46H46N8O6.C45H44N6O6.C43H48N6O6.C41H42N4O6.C39H40N6O6.C38H38N4O6.C32H34N4O6/c1-5-45(55)59-33-9-7-31-53(3)41-23-19-39(20-24-41)51-49-37-15-11-35(12-16-37)47(57)61-43-27-29-44(30-28-43)62-48(58)36-13-17-38(18-14-36)50-52-40-21-25-42(26-22-40)54(4)32-8-10-34-60-46(56)6-2;1-4-46(54)58-34-16-12-8-6-10-14-32-56-43-27-22-40(23-28-43)49-48-38-18-20-39(21-19-38)51-53-45-31-26-42(36-37(45)3)52-50-41-24-29-44(30-25-41)57-33-15-11-7-9-13-17-35-59-47(55)5-2;1-5-45(55)59-29-9-7-27-57-41-21-15-37(16-22-41)48-47-35-11-13-36(14-12-35)50-53-43-26-20-40(32-34(43)4)52-54-44-25-19-39(31-33(44)3)51-49-38-17-23-42(24-18-38)58-28-8-10-30-60-46(56)6-2;1-4-44(52)56-30-8-6-28-54-41-23-12-35(13-24-41)34-10-14-36(15-11-34)46-47-37-16-18-38(19-17-37)49-51-43-27-22-40(32-33(43)3)50-48-39-20-25-42(26-21-39)55-29-7-9-31-57-45(53)5-2;1-4-42(50)54-30-12-8-6-10-28-52-39-23-18-36(19-24-39)45-44-34-14-16-35(17-15-34)47-49-41-27-22-38(32-33(41)3)48-46-37-20-25-40(26-21-37)53-29-11-7-9-13-31-55-43(51)5-2;1-4-40(46)50-26-8-6-24-48-37-19-10-32(11-20-37)29-42-34-14-16-35(17-15-34)44-45-39-23-18-36(28-31(39)3)43-30-33-12-21-38(22-13-33)49-25-7-9-27-51-41(47)5-2;1-4-38(46)50-26-8-6-24-48-35-19-14-32(15-20-35)41-40-30-10-12-31(13-11-30)43-45-37-23-18-34(28-29(37)3)44-42-33-16-21-36(22-17-33)49-25-7-9-27-51-39(47)5-2;1-3-37(43)47-27-7-5-25-45-35-21-17-33(18-22-35)41-39-31-13-9-29(10-14-31)30-11-15-32(16-12-30)40-42-34-19-23-36(24-20-34)46-26-6-8-28-48-38(44)4-2;1-3-31(37)41-23-7-5-21-39-29-17-13-27(14-18-29)35-33-25-9-11-26(12-10-25)34-36-28-15-19-30(20-16-28)40-22-6-8-24-42-32(38)4-2/h5-6,11-30H,1-2,7-10,31-34H2,3-4H3;4-5,18-31,36H,1-2,6-17,32-35H2,3H3;5-6,11-26,31-32H,1-2,7-10,27-30H2,3-4H3;4-5,10-27,32H,1-2,6-9,28-31H2,3H3;4-5,14-27,32H,1-2,6-13,28-31H2,3H3;4-5,10-23,28-30H,1-2,6-9,24-27H2,3H3;4-5,10-23,28H,1-2,6-9,24-27H2,3H3;3-4,9-24H,1-2,5-8,25-28H2;3-4,9-20H,1-2,5-8,21-24H2/b51-49+,52-50+;49-48+,52-50+,53-51+;48-47+,51-49+,53-50+,54-52+;47-46+,50-48+,51-49+;45-44+,48-46+,49-47+;42-29+,43-30+,45-44+;41-40+,44-42+,45-43+;41-39+,42-40+;35-33+,36-34+ |
| InChIKey | ZZJOTXYSUDBPRD-JAYYRQOFSA-N |
| XLogP | 102.95 |
| TPSA | 1273.44 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 106 |
| Rotatable Bonds | 194 |
| Heavy Atoms | 485 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 6547.63 |
| LogP ≤ 5 | 102.95 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 106 |