About 10-[3-(1,3-benzothiazol-2-yl)-5-[3-(1,3-benzothiazol-2-yl)-5-phenothiazin-10-ylphenyl]phenyl]phenothiazine;2-[3-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-phenothiazin-10-ylphenyl]-5-phenothiazin-10-ylphenyl]-[1,3]oxazolo[5,4-b]pyridine;10-[3-[3-phenothiazin-10-yl-5-(1-phenylbenzimidazol-2-yl)phenyl]-5-(1-phenylbenzimidazol-2-yl)phenyl]phenothiazine
10-[3-(1,3-benzothiazol-2-yl)-5-[3-(1,3-benzothiazol-2-yl)-5-phenothiazin-10-ylphenyl]phenyl]phenothiazine;2-[3-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-phenothiazin-10-ylphenyl]-5-phenothiazin-10-ylphenyl]-[1,3]oxazolo[5,4-b]pyridine;10-[3-[3-phenothiazin-10-yl-5-(1-phenylbenzimidazol-2-yl)phenyl]-5-(1-phenylbenzimidazol-2-yl)phenyl]phenothiazine (PubChem CID 158650993) has the molecular formula C160H98N16O2S8
and a molecular weight of 2533.19 g/mol. Its IUPAC name is 10-[3-(1,3-benzothiazol-2-yl)-5-[3-(1,3-benzothiazol-2-yl)-5-phenothiazin-10-ylphenyl]phenyl]phenothiazine;2-[3-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-phenothiazin-10-ylphenyl]-5-phenothiazin-10-ylphenyl]-[1,3]oxazolo[5,4-b]pyridine;10-[3-[3-phenothiazin-10-yl-5-(1-phenylbenzimidazol-2-yl)phenyl]-5-(1-phenylbenzimidazol-2-yl)phenyl]phenothiazine.
Frequently Asked Questions
What is the IUPAC name of 10-[3-(1,3-benzothiazol-2-yl)-5-[3-(1,3-benzothiazol-2-yl)-5-phenothiazin-10-ylphenyl]phenyl]phenothiazine;2-[3-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-phenothiazin-10-ylphenyl]-5-phenothiazin-10-ylphenyl]-[1,3]oxazolo[5,4-b]pyridine;10-[3-[3-phenothiazin-10-yl-5-(1-phenylbenzimidazol-2-yl)phenyl]-5-(1-phenylbenzimidazol-2-yl)phenyl]phenothiazine?
The IUPAC name of 10-[3-(1,3-benzothiazol-2-yl)-5-[3-(1,3-benzothiazol-2-yl)-5-phenothiazin-10-ylphenyl]phenyl]phenothiazine;2-[3-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-phenothiazin-10-ylphenyl]-5-phenothiazin-10-ylphenyl]-[1,3]oxazolo[5,4-b]pyridine;10-[3-[3-phenothiazin-10-yl-5-(1-phenylbenzimidazol-2-yl)phenyl]-5-(1-phenylbenzimidazol-2-yl)phenyl]phenothiazine (CID 158650993) is 10-[3-(1,3-benzothiazol-2-yl)-5-[3-(1,3-benzothiazol-2-yl)-5-phenothiazin-10-ylphenyl]phenyl]phenothiazine;2-[3-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-phenothiazin-10-ylphenyl]-5-phenothiazin-10-ylphenyl]-[1,3]oxazolo[5,4-b]pyridine;10-[3-[3-phenothiazin-10-yl-5-(1-phenylbenzimidazol-2-yl)phenyl]-5-(1-phenylbenzimidazol-2-yl)phenyl]phenothiazine.
What is the SMILES notation for 10-[3-(1,3-benzothiazol-2-yl)-5-[3-(1,3-benzothiazol-2-yl)-5-phenothiazin-10-ylphenyl]phenyl]phenothiazine;2-[3-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-phenothiazin-10-ylphenyl]-5-phenothiazin-10-ylphenyl]-[1,3]oxazolo[5,4-b]pyridine;10-[3-[3-phenothiazin-10-yl-5-(1-phenylbenzimidazol-2-yl)phenyl]-5-(1-phenylbenzimidazol-2-yl)phenyl]phenothiazine?
The canonical SMILES for 10-[3-(1,3-benzothiazol-2-yl)-5-[3-(1,3-benzothiazol-2-yl)-5-phenothiazin-10-ylphenyl]phenyl]phenothiazine;2-[3-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-phenothiazin-10-ylphenyl]-5-phenothiazin-10-ylphenyl]-[1,3]oxazolo[5,4-b]pyridine;10-[3-[3-phenothiazin-10-yl-5-(1-phenylbenzimidazol-2-yl)phenyl]-5-(1-phenylbenzimidazol-2-yl)phenyl]phenothiazine is c1ccc(-n2c(-c3cc(-c4cc(-c5nc6ccccc6n5-c5ccccc5)cc(N5c6ccccc6Sc6ccccc65)c4)cc(N4c5ccccc5Sc5ccccc54)c3)nc3ccccc32)cc1.c1ccc2c(c1)Sc1ccccc1N2c1cc(-c2cc(-c3nc4ccccc4s3)cc(N3c4ccccc4Sc4ccccc43)c2)cc(-c2nc3ccccc3s2)c1.c1ccc2c(c1)Sc1ccccc1N2c1cc(-c2cc(-c3nc4cccnc4o3)cc(N3c4ccccc4Sc4ccccc43)c2)cc(-c2nc3cccnc3o2)c1.
What is the InChIKey of 10-[3-(1,3-benzothiazol-2-yl)-5-[3-(1,3-benzothiazol-2-yl)-5-phenothiazin-10-ylphenyl]phenyl]phenothiazine;2-[3-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-phenothiazin-10-ylphenyl]-5-phenothiazin-10-ylphenyl]-[1,3]oxazolo[5,4-b]pyridine;10-[3-[3-phenothiazin-10-yl-5-(1-phenylbenzimidazol-2-yl)phenyl]-5-(1-phenylbenzimidazol-2-yl)phenyl]phenothiazine?
The InChIKey is IBNZYMVOMMCDKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H40N6S2.C50H30N4S4.C48H28N6O2S2/c1-3-19-45(20-4-1)67-51-25-9-7-23-49(51)63-61(67)43-35-41(37-47(39-43)65-53-27-11-15-31-57(53)69-58-32-16-12-28-54(58)65)42-36-44(62-64-50-24-8-10-26-52(50)68(62)46-21-5-2-6-22-46)40-48(38-42)66-55-29-13-17-33-59(55)70-60-34-18-14-30-56(60)66;1-7-19-43-37(13-1)51-49(57-43)33-25-31(27-35(29-33)53-39-15-3-9-21-45(39)55-46-22-10-4-16-40(46)53)32-26-34(50-52-38-14-2-8-20-44(38)58-50)30-36(28-32)54-41-17-5-11-23-47(41)56-48-24-12-6-18-42(48)54;1-5-17-41-37(13-1)53(38-14-2-6-18-42(38)57-41)33-25-29(23-31(27-33)45-51-35-11-9-21-49-47(35)55-45)30-24-32(46-52-36-12-10-22-50-48(36)56-46)28-34(26-30)54-39-15-3-7-19-43(39)58-44-20-8-4-16-40(44)54/h1-40H;1-30H;1-28H.
What are the key properties of 10-[3-(1,3-benzothiazol-2-yl)-5-[3-(1,3-benzothiazol-2-yl)-5-phenothiazin-10-ylphenyl]phenyl]phenothiazine;2-[3-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-phenothiazin-10-ylphenyl]-5-phenothiazin-10-ylphenyl]-[1,3]oxazolo[5,4-b]pyridine;10-[3-[3-phenothiazin-10-yl-5-(1-phenylbenzimidazol-2-yl)phenyl]-5-(1-phenylbenzimidazol-2-yl)phenyl]phenothiazine?
10-[3-(1,3-benzothiazol-2-yl)-5-[3-(1,3-benzothiazol-2-yl)-5-phenothiazin-10-ylphenyl]phenyl]phenothiazine;2-[3-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-phenothiazin-10-ylphenyl]-5-phenothiazin-10-ylphenyl]-[1,3]oxazolo[5,4-b]pyridine;10-[3-[3-phenothiazin-10-yl-5-(1-phenylbenzimidazol-2-yl)phenyl]-5-(1-phenylbenzimidazol-2-yl)phenyl]phenothiazine has a molecular weight of 2533.19 g/mol, XLogP of 46.64, 17 rotatable bonds, 0 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[3-(1,3-benzothiazol-2-yl)-5-[3-(1,3-benzothiazol-2-yl)-5-phenothiazin-10-ylphenyl]phenyl]phenothiazine;2-[3-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-phenothiazin-10-ylphenyl]-5-phenothiazin-10-ylphenyl]-[1,3]oxazolo[5,4-b]pyridine;10-[3-[3-phenothiazin-10-yl-5-(1-phenylbenzimidazol-2-yl)phenyl]-5-(1-phenylbenzimidazol-2-yl)phenyl]phenothiazine is sourced from PubChem (CID 158650993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).