C374H465N57O48S — CID 167667609
10-[4-[[4-[[4-[bis(2-hydroxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenoxy]decyl propanoate;1-O-butyl 4-O-[2-[4-[[4-[[4-(diethylamino)phenyl]diazenyl]phenyl]diazenyl]phenyl]ethyl] butanedioate;[4-[[4-[[4-[2-cyanoethyl(ethyl)amino]phenyl]diazenyl]phenyl]diazenyl]-3-hydroxyphenoxy]methyl propanoate;10-[4-[[4-[[4-[2-cyanoethyl(2-hydroxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenoxy]decyl propanoate;9-[4-[[4-[[4-[ethyl(2-hydroxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenoxy]nonyl propanoate;8-[4-[[4-[[4-[ethyl(2-propanoyloxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenoxy]octyl butanoate;9-[4-[[4-[[4-[ethyl(2-prop-2-enoyloxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenoxy]nonyl propanoate;[10-[4-[[4-[[4-[ethyl(2-prop-2-enoyloxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenyl]-10-oxodecyl] propanoate;9-propanoyloxynonyl 4-[[4-[[4-[ethyl(2-prop-2-enoyloxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]benzoate;[4-[[4-[(4-pyrrolidin-1-ylphenyl)diazenyl]phenyl]diazenyl]phenoxy]methyl propanoate;9-[4-[[4-[(4-thiomorpholin-4-ylphenyl)diazenyl]phenyl]diazenyl]phenoxy]nonyl propanoate (PubChem CID 167667609) has the molecular formula C374H465N57O48S and a molecular weight of 6559.25 g/mol. Its IUPAC name is 10-[4-[[4-[[4-[bis(2-hydroxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenoxy]decyl propanoate;1-O-butyl 4-O-[2-[4-[[4-[[4-(diethylamino)phenyl]diazenyl]phenyl]diazenyl]phenyl]ethyl] butanedioate;[4-[[4-[[4-[2-cyanoethyl(ethyl)amino]phenyl]diazenyl]phenyl]diazenyl]-3-hydroxyphenoxy]methyl propanoate;10-[4-[[4-[[4-[2-cyanoethyl(2-hydroxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenoxy]decyl propanoate;9-[4-[[4-[[4-[ethyl(2-hydroxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenoxy]nonyl propanoate;8-[4-[[4-[[4-[ethyl(2-propanoyloxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenoxy]octyl butanoate;9-[4-[[4-[[4-[ethyl(2-prop-2-enoyloxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenoxy]nonyl propanoate;[10-[4-[[4-[[4-[ethyl(2-prop-2-enoyloxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenyl]-10-oxodecyl] propanoate;9-propanoyloxynonyl 4-[[4-[[4-[ethyl(2-prop-2-enoyloxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]benzoate;[4-[[4-[(4-pyrrolidin-1-ylphenyl)diazenyl]phenyl]diazenyl]phenoxy]methyl propanoate;9-[4-[[4-[(4-thiomorpholin-4-ylphenyl)diazenyl]phenyl]diazenyl]phenoxy]nonyl propanoate.
| Compound Name | 10-[4-[[4-[[4-[bis(2-hydroxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenoxy]decyl propanoate;1-O-butyl 4-O-[2-[4-[[4-[[4-(diethylamino)phenyl]diazenyl]phenyl]diazenyl]phenyl]ethyl] butanedioate;[4-[[4-[[4-[2-cyanoethyl(ethyl)amino]phenyl]diazenyl]phenyl]diazenyl]-3-hydroxyphenoxy]methyl propanoate;10-[4-[[4-[[4-[2-cyanoethyl(2-hydroxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenoxy]decyl propanoate;9-[4-[[4-[[4-[ethyl(2-hydroxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenoxy]nonyl propanoate;8-[4-[[4-[[4-[ethyl(2-propanoyloxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenoxy]octyl butanoate;9-[4-[[4-[[4-[ethyl(2-prop-2-enoyloxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenoxy]nonyl propanoate;[10-[4-[[4-[[4-[ethyl(2-prop-2-enoyloxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenyl]-10-oxodecyl] propanoate;9-propanoyloxynonyl 4-[[4-[[4-[ethyl(2-prop-2-enoyloxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]benzoate;[4-[[4-[(4-pyrrolidin-1-ylphenyl)diazenyl]phenyl]diazenyl]phenoxy]methyl propanoate;9-[4-[[4-[(4-thiomorpholin-4-ylphenyl)diazenyl]phenyl]diazenyl]phenoxy]nonyl propanoate |
|---|---|
| PubChem CID | 167667609 |
| Molecular Formula | C374H465N57O48S |
| Molecular Weight | 6559.25 g/mol |
| Exact Mass | 6554.54 |
| IUPAC Name | 10-[4-[[4-[[4-[bis(2-hydroxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenoxy]decyl propanoate;1-O-butyl 4-O-[2-[4-[[4-[[4-(diethylamino)phenyl]diazenyl]phenyl]diazenyl]phenyl]ethyl] butanedioate;[4-[[4-[[4-[2-cyanoethyl(ethyl)amino]phenyl]diazenyl]phenyl]diazenyl]-3-hydroxyphenoxy]methyl propanoate;10-[4-[[4-[[4-[2-cyanoethyl(2-hydroxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenoxy]decyl propanoate;9-[4-[[4-[[4-[ethyl(2-hydroxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenoxy]nonyl propanoate;8-[4-[[4-[[4-[ethyl(2-propanoyloxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenoxy]octyl butanoate;9-[4-[[4-[[4-[ethyl(2-prop-2-enoyloxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenoxy]nonyl propanoate;[10-[4-[[4-[[4-[ethyl(2-prop-2-enoyloxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]phenyl]-10-oxodecyl] propanoate;9-propanoyloxynonyl 4-[[4-[[4-[ethyl(2-prop-2-enoyloxyethyl)amino]phenyl]diazenyl]phenyl]diazenyl]benzoate;[4-[[4-[(4-pyrrolidin-1-ylphenyl)diazenyl]phenyl]diazenyl]phenoxy]methyl propanoate;9-[4-[[4-[(4-thiomorpholin-4-ylphenyl)diazenyl]phenyl]diazenyl]phenoxy]nonyl propanoate |
| SMILES | C=CC(=O)OCCN(CC)c1ccc(/N=N/c2ccc(/N=N/c3ccc(C(=O)CCCCCCCCCOC(=O)CC)cc3)cc2)cc1.C=CC(=O)OCCN(CC)c1ccc(/N=N/c2ccc(/N=N/c3ccc(C(=O)OCCCCCCCCCOC(=O)CC)cc3)cc2)cc1.C=CC(=O)OCCN(CC)c1ccc(/N=N/c2ccc(/N=N/c3ccc(OCCCCCCCCCOC(=O)CC)cc3)cc2)cc1.CCC(=O)OCCCCCCCCCCOc1ccc(/N=N/c2ccc(/N=N/c3ccc(N(CCO)CCC#N)cc3)cc2)cc1.CCC(=O)OCCCCCCCCCCOc1ccc(/N=N/c2ccc(/N=N/c3ccc(N(CCO)CCO)cc3)cc2)cc1.CCC(=O)OCCCCCCCCCOc1ccc(/N=N/c2ccc(/N=N/c3ccc(N(CC)CCO)cc3)cc2)cc1.CCC(=O)OCCCCCCCCCOc1ccc(/N=N/c2ccc(/N=N/c3ccc(N4CCSCC4)cc3)cc2)cc1.CCC(=O)OCOc1ccc(/N=N/c2ccc(/N=N/c3ccc(N(CC)CCC#N)cc3)cc2)c(O)c1.CCC(=O)OCOc1ccc(/N=N/c2ccc(/N=N/c3ccc(N4CCCC4)cc3)cc2)cc1.CCCC(=O)OCCCCCCCCOc1ccc(/N=N/c2ccc(/N=N/c3ccc(N(CC)CCOC(=O)CC)cc3)cc2)cc1.CCCCOC(=O)CCC(=O)OCCc1ccc(/N=N/c2ccc(/N=N/c3ccc(N(CC)CC)cc3)cc2)cc1 |
| InChI | InChI=1S/C38H47N5O6.C38H47N5O5.C37H47N5O5.C37H49N5O5.C36H46N6O4.C35H47N5O5.C34H45N5O4.C34H43N5O3S.C32H39N5O4.C27H28N6O4.C26H27N5O3/c1-4-36(44)47-27-12-10-8-7-9-11-13-28-49-38(46)30-14-16-31(17-15-30)39-40-32-18-20-33(21-19-32)41-42-34-22-24-35(25-23-34)43(6-3)26-29-48-37(45)5-2;1-4-37(45)47-28-13-11-9-7-8-10-12-14-36(44)30-15-17-31(18-16-30)39-40-32-19-21-33(22-20-32)41-42-34-23-25-35(26-24-34)43(6-3)27-29-48-38(46)5-2;1-4-36(43)46-28-13-11-9-7-8-10-12-27-45-35-24-20-33(21-25-35)41-39-31-16-14-30(15-17-31)38-40-32-18-22-34(23-19-32)42(6-3)26-29-47-37(44)5-2;1-4-13-37(44)46-28-12-10-8-7-9-11-27-45-35-24-20-33(21-25-35)41-39-31-16-14-30(15-17-31)38-40-32-18-22-34(23-19-32)42(6-3)26-29-47-36(43)5-2;1-2-36(44)46-29-10-8-6-4-3-5-7-9-28-45-35-22-18-33(19-23-35)41-39-31-14-12-30(13-15-31)38-40-32-16-20-34(21-17-32)42(26-27-43)25-11-24-37;1-2-35(43)45-28-10-8-6-4-3-5-7-9-27-44-34-21-17-32(18-22-34)39-37-30-13-11-29(12-14-30)36-38-31-15-19-33(20-16-31)40(23-25-41)24-26-42;1-3-34(41)43-27-11-9-7-5-6-8-10-26-42-33-22-18-31(19-23-33)38-36-29-14-12-28(13-15-29)35-37-30-16-20-32(21-17-30)39(4-2)24-25-40;1-2-34(40)42-25-9-7-5-3-4-6-8-24-41-33-20-16-31(17-21-33)38-36-29-12-10-28(11-13-29)35-37-30-14-18-32(19-15-30)39-22-26-43-27-23-39;1-4-7-23-40-31(38)20-21-32(39)41-24-22-25-8-10-26(11-9-25)33-34-27-12-14-28(15-13-27)35-36-29-16-18-30(19-17-29)37(5-2)6-3;1-3-27(35)37-19-36-24-14-15-25(26(34)18-24)32-31-21-8-6-20(7-9-21)29-30-22-10-12-23(13-11-22)33(4-2)17-5-16-28;1-2-26(32)34-19-33-25-15-11-23(12-16-25)30-28-21-7-5-20(6-8-21)27-29-22-9-13-24(14-10-22)31-17-3-4-18-31/h5,14-25H,2,4,6-13,26-29H2,1,3H3;5,15-26H,2,4,6-14,27-29H2,1,3H3;5,14-25H,2,4,6-13,26-29H2,1,3H3;14-25H,4-13,26-29H2,1-3H3;12-23,43H,2-11,25-29H2,1H3;11-22,41-42H,2-10,23-28H2,1H3;12-23,40H,3-11,24-27H2,1-2H3;10-21H,2-9,22-27H2,1H3;8-19H,4-7,20-24H2,1-3H3;6-15,18,34H,3-5,17,19H2,1-2H3;5-16H,2-4,17-19H2,1H3/b2*40-39+,42-41+;3*40-38+,41-39+;38-36+,39-37+;2*37-35+,38-36+;34-33+,36-35+;30-29+,32-31+;29-27+,30-28+ |
| InChIKey | SWEJUVZRGZXMJX-IAQCPYSZSA-N |
| XLogP | 101.95 |
| TPSA | 1266.22 Ų |
| H-Bond Donors | 5 |
| H-Bond Acceptors | 106 |
| Rotatable Bonds | 206 |
| Heavy Atoms | 480 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 6559.25 |
| LogP ≤ 5 | 101.95 |
| H-Bond Donors ≤ 5 | 5 |
| H-Bond Acceptors ≤ 10 | 106 |