3-(3-dibenzothiophen-4-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-naphthalen-1-ylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-1-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-2-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[2-(6-phenylnaphthalen-2-yl)-4-quinoxalin-2-ylphenyl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(3-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;10-phenyl-3-[3-(28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaen-3-yl)quinoxalin-2-yl]phenoxazine

C384H221N25OS9 — CID 162156099

IUPAC3-(3-dibenzothiophen-4-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-naphthalen-1-ylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-1-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-2-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[2-(6-phenylnaphthalen-2-yl)-4-quinoxalin-2-ylphenyl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(3-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;10-phenyl-3-[3-(28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaen-3-yl)quinoxalin-2-yl]phenoxazine
SMILESc1ccc(-c2ccc(-c3nc4ccccc4nc3-n3c4ccccc4c4c5ccccc5c5c6cc7ccccc7cc6sc5c43)cc2)cc1.c1ccc(-c2ccc3cc(-c4cc(-c5cnc6ccccc6n5)ccc4-n4c5ccccc5c5c6ccccc6c6c7cc8ccccc8cc7sc6c54)ccc3c2)cc1.c1ccc(-c2cccc(-c3nc4ccccc4nc3-n3c4ccccc4c4c5ccccc5c5c6cc7ccccc7cc6sc5c43)c2)cc1.c1ccc(N2c3ccccc3Oc3cc(-c4nc5ccccc5nc4-n4c5ccccc5c5c6ccccc6c6c7cc8ccccc8cc7sc6c54)ccc32)cc1.c1ccc2cc(-c3nc4ccccc4nc3-n3c4ccccc4c4c5ccccc5c5c6cc7ccccc7cc6sc5c43)ccc2c1.c1ccc2cc3c(cc2c1)sc1c3c2ccccc2c2c3ccccc3n(-c3nc4ccccc4nc3-c3ccc(-c4cccc5ccccc45)cc3)c12.c1ccc2cc3c(cc2c1)sc1c3c2ccccc2c2c3ccccc3n(-c3nc4ccccc4nc3-c3cccc4c3sc3ccccc34)c12.c1ccc2cc3c(cc2c1)sc1c3c2ccccc2c2c3ccccc3n(-c3nc4ccccc4nc3-c3cccc4ccccc34)c12
InChIInChI=1S/C56H33N3S.C52H30N4OS.C50H29N3S.C46H25N3S2.2C46H27N3S.2C44H25N3S/c1-2-12-34(13-3-1)37-22-23-39-29-40(25-24-38(39)28-37)45-31-41(49-33-57-47-19-9-10-20-48(47)58-49)26-27-51(45)59-50-21-11-8-18-44(50)53-42-16-6-7-17-43(42)54-46-30-35-14-4-5-15-36(35)32-52(46)60-56(54)55(53)59;1-2-16-34(17-3-1)55-42-24-12-13-25-44(42)57-45-29-33(26-27-43(45)55)49-52(54-40-22-10-9-21-39(40)53-49)56-41-23-11-8-20-37(41)47-35-18-6-7-19-36(35)48-38-28-31-14-4-5-15-32(31)30-46(38)58-51(48)50(47)56;1-2-14-34-29-44-40(28-33(34)13-1)46-38-18-6-5-17-37(38)45-39-19-7-10-23-43(39)53(48(45)49(46)54-44)50-47(51-41-21-8-9-22-42(41)52-50)32-26-24-31(25-27-32)36-20-11-15-30-12-3-4-16-35(30)36;1-2-13-27-25-39-34(24-26(27)12-1)41-30-16-4-3-15-29(30)40-32-17-5-9-22-37(32)49(43(40)45(41)51-39)46-42(47-35-20-7-8-21-36(35)48-46)33-19-11-18-31-28-14-6-10-23-38(28)50-44(31)33;1-2-13-28(14-3-1)29-17-12-18-32(25-29)43-46(48-38-23-10-9-22-37(38)47-43)49-39-24-11-8-21-35(39)41-33-19-6-7-20-34(33)42-36-26-30-15-4-5-16-31(30)27-40(36)50-45(42)44(41)49;1-2-12-28(13-3-1)29-22-24-30(25-23-29)43-46(48-38-20-10-9-19-37(38)47-43)49-39-21-11-8-18-35(39)41-33-16-6-7-17-34(33)42-36-26-31-14-4-5-15-32(31)27-40(36)50-45(42)44(41)49;1-2-14-28-25-38-34(24-27(28)13-1)40-31-18-6-5-17-30(31)39-33-19-7-10-23-37(33)47(42(39)43(40)48-38)44-41(45-35-21-8-9-22-36(35)46-44)32-20-11-15-26-12-3-4-16-29(26)32;1-2-12-27-23-30(22-21-26(27)11-1)41-44(46-36-19-9-8-18-35(36)45-41)47-37-20-10-7-17-33(37)39-31-15-5-6-16-32(31)40-34-24-28-13-3-4-14-29(28)25-38(34)48-43(40)42(39)47/h1-33H;1-30H;1-29H;1-25H;2*1-27H;2*1-25H
InChIKeyZLVORVSJSWEQIT-UHFFFAOYSA-N
MW5489.77 g/mol
LogP107.44
Rot. Bonds22

About 3-(3-dibenzothiophen-4-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-naphthalen-1-ylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-1-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-2-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[2-(6-phenylnaphthalen-2-yl)-4-quinoxalin-2-ylphenyl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(3-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;10-phenyl-3-[3-(28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaen-3-yl)quinoxalin-2-yl]phenoxazine

3-(3-dibenzothiophen-4-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-naphthalen-1-ylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-1-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-2-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[2-(6-phenylnaphthalen-2-yl)-4-quinoxalin-2-ylphenyl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(3-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;10-phenyl-3-[3-(28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaen-3-yl)quinoxalin-2-yl]phenoxazine (PubChem CID 162156099) has the molecular formula C384H221N25OS9 and a molecular weight of 5489.77 g/mol. Its IUPAC name is 3-(3-dibenzothiophen-4-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-naphthalen-1-ylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-1-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-2-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[2-(6-phenylnaphthalen-2-yl)-4-quinoxalin-2-ylphenyl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(3-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;10-phenyl-3-[3-(28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaen-3-yl)quinoxalin-2-yl]phenoxazine.

Molecular Properties

Compound Name3-(3-dibenzothiophen-4-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-naphthalen-1-ylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-1-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-2-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[2-(6-phenylnaphthalen-2-yl)-4-quinoxalin-2-ylphenyl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(3-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;10-phenyl-3-[3-(28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaen-3-yl)quinoxalin-2-yl]phenoxazine
PubChem CID162156099
Molecular FormulaC384H221N25OS9
Molecular Weight5489.77 g/mol
Exact Mass5484.55
IUPAC Name3-(3-dibenzothiophen-4-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-naphthalen-1-ylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-1-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-2-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[2-(6-phenylnaphthalen-2-yl)-4-quinoxalin-2-ylphenyl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(3-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;10-phenyl-3-[3-(28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaen-3-yl)quinoxalin-2-yl]phenoxazine
SMILESc1ccc(-c2ccc(-c3nc4ccccc4nc3-n3c4ccccc4c4c5ccccc5c5c6cc7ccccc7cc6sc5c43)cc2)cc1.c1ccc(-c2ccc3cc(-c4cc(-c5cnc6ccccc6n5)ccc4-n4c5ccccc5c5c6ccccc6c6c7cc8ccccc8cc7sc6c54)ccc3c2)cc1.c1ccc(-c2cccc(-c3nc4ccccc4nc3-n3c4ccccc4c4c5ccccc5c5c6cc7ccccc7cc6sc5c43)c2)cc1.c1ccc(N2c3ccccc3Oc3cc(-c4nc5ccccc5nc4-n4c5ccccc5c5c6ccccc6c6c7cc8ccccc8cc7sc6c54)ccc32)cc1.c1ccc2cc(-c3nc4ccccc4nc3-n3c4ccccc4c4c5ccccc5c5c6cc7ccccc7cc6sc5c43)ccc2c1.c1ccc2cc3c(cc2c1)sc1c3c2ccccc2c2c3ccccc3n(-c3nc4ccccc4nc3-c3ccc(-c4cccc5ccccc45)cc3)c12.c1ccc2cc3c(cc2c1)sc1c3c2ccccc2c2c3ccccc3n(-c3nc4ccccc4nc3-c3cccc4c3sc3ccccc34)c12.c1ccc2cc3c(cc2c1)sc1c3c2ccccc2c2c3ccccc3n(-c3nc4ccccc4nc3-c3cccc4ccccc34)c12
InChIInChI=1S/C56H33N3S.C52H30N4OS.C50H29N3S.C46H25N3S2.2C46H27N3S.2C44H25N3S/c1-2-12-34(13-3-1)37-22-23-39-29-40(25-24-38(39)28-37)45-31-41(49-33-57-47-19-9-10-20-48(47)58-49)26-27-51(45)59-50-21-11-8-18-44(50)53-42-16-6-7-17-43(42)54-46-30-35-14-4-5-15-36(35)32-52(46)60-56(54)55(53)59;1-2-16-34(17-3-1)55-42-24-12-13-25-44(42)57-45-29-33(26-27-43(45)55)49-52(54-40-22-10-9-21-39(40)53-49)56-41-23-11-8-20-37(41)47-35-18-6-7-19-36(35)48-38-28-31-14-4-5-15-32(31)30-46(38)58-51(48)50(47)56;1-2-14-34-29-44-40(28-33(34)13-1)46-38-18-6-5-17-37(38)45-39-19-7-10-23-43(39)53(48(45)49(46)54-44)50-47(51-41-21-8-9-22-42(41)52-50)32-26-24-31(25-27-32)36-20-11-15-30-12-3-4-16-35(30)36;1-2-13-27-25-39-34(24-26(27)12-1)41-30-16-4-3-15-29(30)40-32-17-5-9-22-37(32)49(43(40)45(41)51-39)46-42(47-35-20-7-8-21-36(35)48-46)33-19-11-18-31-28-14-6-10-23-38(28)50-44(31)33;1-2-13-28(14-3-1)29-17-12-18-32(25-29)43-46(48-38-23-10-9-22-37(38)47-43)49-39-24-11-8-21-35(39)41-33-19-6-7-20-34(33)42-36-26-30-15-4-5-16-31(30)27-40(36)50-45(42)44(41)49;1-2-12-28(13-3-1)29-22-24-30(25-23-29)43-46(48-38-20-10-9-19-37(38)47-43)49-39-21-11-8-18-35(39)41-33-16-6-7-17-34(33)42-36-26-31-14-4-5-15-32(31)27-40(36)50-45(42)44(41)49;1-2-14-28-25-38-34(24-27(28)13-1)40-31-18-6-5-17-30(31)39-33-19-7-10-23-37(33)47(42(39)43(40)48-38)44-41(45-35-21-8-9-22-36(35)46-44)32-20-11-15-26-12-3-4-16-29(26)32;1-2-12-27-23-30(22-21-26(27)11-1)41-44(46-36-19-9-8-18-35(36)45-41)47-37-20-10-7-17-33(37)39-31-15-5-6-16-32(31)40-34-24-28-13-3-4-14-29(28)25-38(34)48-43(40)42(39)47/h1-33H;1-30H;1-29H;1-25H;2*1-27H;2*1-25H
InChIKeyZLVORVSJSWEQIT-UHFFFAOYSA-N
XLogP107.44
TPSA258.15 Ų
H-Bond Donors
H-Bond Acceptors35
Rotatable Bonds22
Heavy Atoms419
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005489.77
LogP ≤ 5107.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1035

Analyze 3-(3-dibenzothiophen-4-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-naphthalen-1-ylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-1-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-2-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[2-(6-phenylnaphthalen-2-yl)-4-quinoxalin-2-ylphenyl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(3-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;10-phenyl-3-[3-(28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaen-3-yl)quinoxalin-2-yl]phenoxazine with MolForge

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Related Compounds

CID 161901264
CID 161901264
CID 132080914
CID 132080914
CID 134601847
CID 134601847
CID 139484324
CID 139484324
CID 157059656
CID 157059656
CID 157079077
CID 157079077
CID 157093885
CID 157093885
CID 157096613
CID 157096613
CID 157115316
CID 157115316
CID 157128160
CID 157128160
CID 157155469
CID 157155469
CID 157190298
CID 157190298

Frequently Asked Questions

What is the IUPAC name of 3-(3-dibenzothiophen-4-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-naphthalen-1-ylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-1-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-2-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[2-(6-phenylnaphthalen-2-yl)-4-quinoxalin-2-ylphenyl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(3-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;10-phenyl-3-[3-(28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaen-3-yl)quinoxalin-2-yl]phenoxazine?
The IUPAC name of 3-(3-dibenzothiophen-4-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-naphthalen-1-ylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-1-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-2-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[2-(6-phenylnaphthalen-2-yl)-4-quinoxalin-2-ylphenyl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(3-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;10-phenyl-3-[3-(28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaen-3-yl)quinoxalin-2-yl]phenoxazine (CID 162156099) is 3-(3-dibenzothiophen-4-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-naphthalen-1-ylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-1-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-2-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[2-(6-phenylnaphthalen-2-yl)-4-quinoxalin-2-ylphenyl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(3-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;10-phenyl-3-[3-(28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaen-3-yl)quinoxalin-2-yl]phenoxazine.
What is the SMILES notation for 3-(3-dibenzothiophen-4-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-naphthalen-1-ylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-1-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-2-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[2-(6-phenylnaphthalen-2-yl)-4-quinoxalin-2-ylphenyl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(3-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;10-phenyl-3-[3-(28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaen-3-yl)quinoxalin-2-yl]phenoxazine?
The canonical SMILES for 3-(3-dibenzothiophen-4-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-naphthalen-1-ylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-1-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-2-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[2-(6-phenylnaphthalen-2-yl)-4-quinoxalin-2-ylphenyl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(3-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;10-phenyl-3-[3-(28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaen-3-yl)quinoxalin-2-yl]phenoxazine is c1ccc(-c2ccc(-c3nc4ccccc4nc3-n3c4ccccc4c4c5ccccc5c5c6cc7ccccc7cc6sc5c43)cc2)cc1.c1ccc(-c2ccc3cc(-c4cc(-c5cnc6ccccc6n5)ccc4-n4c5ccccc5c5c6ccccc6c6c7cc8ccccc8cc7sc6c54)ccc3c2)cc1.c1ccc(-c2cccc(-c3nc4ccccc4nc3-n3c4ccccc4c4c5ccccc5c5c6cc7ccccc7cc6sc5c43)c2)cc1.c1ccc(N2c3ccccc3Oc3cc(-c4nc5ccccc5nc4-n4c5ccccc5c5c6ccccc6c6c7cc8ccccc8cc7sc6c54)ccc32)cc1.c1ccc2cc(-c3nc4ccccc4nc3-n3c4ccccc4c4c5ccccc5c5c6cc7ccccc7cc6sc5c43)ccc2c1.c1ccc2cc3c(cc2c1)sc1c3c2ccccc2c2c3ccccc3n(-c3nc4ccccc4nc3-c3ccc(-c4cccc5ccccc45)cc3)c12.c1ccc2cc3c(cc2c1)sc1c3c2ccccc2c2c3ccccc3n(-c3nc4ccccc4nc3-c3cccc4c3sc3ccccc34)c12.c1ccc2cc3c(cc2c1)sc1c3c2ccccc2c2c3ccccc3n(-c3nc4ccccc4nc3-c3cccc4ccccc34)c12.
What is the InChIKey of 3-(3-dibenzothiophen-4-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-naphthalen-1-ylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-1-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-2-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[2-(6-phenylnaphthalen-2-yl)-4-quinoxalin-2-ylphenyl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(3-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;10-phenyl-3-[3-(28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaen-3-yl)quinoxalin-2-yl]phenoxazine?
The InChIKey is ZLVORVSJSWEQIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H33N3S.C52H30N4OS.C50H29N3S.C46H25N3S2.2C46H27N3S.2C44H25N3S/c1-2-12-34(13-3-1)37-22-23-39-29-40(25-24-38(39)28-37)45-31-41(49-33-57-47-19-9-10-20-48(47)58-49)26-27-51(45)59-50-21-11-8-18-44(50)53-42-16-6-7-17-43(42)54-46-30-35-14-4-5-15-36(35)32-52(46)60-56(54)55(53)59;1-2-16-34(17-3-1)55-42-24-12-13-25-44(42)57-45-29-33(26-27-43(45)55)49-52(54-40-22-10-9-21-39(40)53-49)56-41-23-11-8-20-37(41)47-35-18-6-7-19-36(35)48-38-28-31-14-4-5-15-32(31)30-46(38)58-51(48)50(47)56;1-2-14-34-29-44-40(28-33(34)13-1)46-38-18-6-5-17-37(38)45-39-19-7-10-23-43(39)53(48(45)49(46)54-44)50-47(51-41-21-8-9-22-42(41)52-50)32-26-24-31(25-27-32)36-20-11-15-30-12-3-4-16-35(30)36;1-2-13-27-25-39-34(24-26(27)12-1)41-30-16-4-3-15-29(30)40-32-17-5-9-22-37(32)49(43(40)45(41)51-39)46-42(47-35-20-7-8-21-36(35)48-46)33-19-11-18-31-28-14-6-10-23-38(28)50-44(31)33;1-2-13-28(14-3-1)29-17-12-18-32(25-29)43-46(48-38-23-10-9-22-37(38)47-43)49-39-24-11-8-21-35(39)41-33-19-6-7-20-34(33)42-36-26-30-15-4-5-16-31(30)27-40(36)50-45(42)44(41)49;1-2-12-28(13-3-1)29-22-24-30(25-23-29)43-46(48-38-20-10-9-19-37(38)47-43)49-39-21-11-8-18-35(39)41-33-16-6-7-17-34(33)42-36-26-31-14-4-5-15-32(31)27-40(36)50-45(42)44(41)49;1-2-14-28-25-38-34(24-27(28)13-1)40-31-18-6-5-17-30(31)39-33-19-7-10-23-37(33)47(42(39)43(40)48-38)44-41(45-35-21-8-9-22-36(35)46-44)32-20-11-15-26-12-3-4-16-29(26)32;1-2-12-27-23-30(22-21-26(27)11-1)41-44(46-36-19-9-8-18-35(36)45-41)47-37-20-10-7-17-33(37)39-31-15-5-6-16-32(31)40-34-24-28-13-3-4-14-29(28)25-38(34)48-43(40)42(39)47/h1-33H;1-30H;1-29H;1-25H;2*1-27H;2*1-25H.
What are the key properties of 3-(3-dibenzothiophen-4-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-naphthalen-1-ylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-1-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-2-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[2-(6-phenylnaphthalen-2-yl)-4-quinoxalin-2-ylphenyl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(3-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;10-phenyl-3-[3-(28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaen-3-yl)quinoxalin-2-yl]phenoxazine?
3-(3-dibenzothiophen-4-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-naphthalen-1-ylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-1-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-2-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[2-(6-phenylnaphthalen-2-yl)-4-quinoxalin-2-ylphenyl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(3-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;10-phenyl-3-[3-(28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaen-3-yl)quinoxalin-2-yl]phenoxazine has a molecular weight of 5489.77 g/mol, XLogP of 107.44, 22 rotatable bonds, 0 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-dibenzothiophen-4-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-naphthalen-1-ylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-1-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-(3-naphthalen-2-ylquinoxalin-2-yl)-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[2-(6-phenylnaphthalen-2-yl)-4-quinoxalin-2-ylphenyl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(3-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;3-[3-(4-phenylphenyl)quinoxalin-2-yl]-28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaene;10-phenyl-3-[3-(28-thia-3-azaheptacyclo[15.11.0.02,10.04,9.011,16.018,27.020,25]octacosa-1(17),2(10),4,6,8,11,13,15,18,20,22,24,26-tridecaen-3-yl)quinoxalin-2-yl]phenoxazine is sourced from PubChem (CID 162156099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).