5-carbazol-9-yl-2,7-bis(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;5-carbazol-9-yl-7-(4-carbazol-9-ylphenyl)-2-(5-carbazol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine;10-[4-[2-(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]phenyl]phenoxazine;10-[3-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine

C173H106N18O2S4 — CID 161124067

IUPAC5-carbazol-9-yl-2,7-bis(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;5-carbazol-9-yl-7-(4-carbazol-9-ylphenyl)-2-(5-carbazol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine;10-[4-[2-(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]phenyl]phenoxazine;10-[3-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine
SMILESc1cc(-c2nc3ncccc3s2)cc(N2c3ccccc3Oc3ccccc32)c1.c1ccc2c(c1)Oc1ccccc1N2c1ccc(-c2cnc3nc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)sc3c2)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2cc(-n3c4ccccc4c4ccccc43)nc3nc(-c4ccc(-n5c6ccccc6c6ccccc65)cn4)sc23)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2nc3nc(-n4c5ccccc5c5ccccc54)cc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3s2)cc1
InChIInChI=1S/C54H33N5S.C53H32N6S.C42H26N4OS.C24H15N3OS/c1-7-19-45-38(13-1)39-14-2-8-20-46(39)57(45)36-29-25-34(26-30-36)44-33-51(59-49-23-11-5-17-42(49)43-18-6-12-24-50(43)59)55-53-52(44)60-54(56-53)35-27-31-37(32-28-35)58-47-21-9-3-15-40(47)41-16-4-10-22-48(41)58;1-7-19-44-36(13-1)37-14-2-8-20-45(37)57(44)34-27-25-33(26-28-34)42-31-50(59-48-23-11-5-17-40(48)41-18-6-12-24-49(41)59)55-52-51(42)60-53(56-52)43-30-29-35(32-54-43)58-46-21-9-3-15-38(46)39-16-4-10-22-47(39)58;1-3-11-34-32(9-1)33-10-2-4-12-35(33)45(34)30-23-19-28(20-24-30)42-44-41-40(48-42)25-29(26-43-41)27-17-21-31(22-18-27)46-36-13-5-7-15-38(36)47-39-16-8-6-14-37(39)46;1-3-11-20-18(9-1)27(19-10-2-4-12-21(19)28-20)17-8-5-7-16(15-17)24-26-23-22(29-24)13-6-14-25-23/h1-33H;1-32H;1-26H;1-15H
InChIKeyULIBXUYYERWDAJ-UHFFFAOYSA-N
MW2597.14 g/mol
LogP46.66
Rot. Bonds16

About 5-carbazol-9-yl-2,7-bis(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;5-carbazol-9-yl-7-(4-carbazol-9-ylphenyl)-2-(5-carbazol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine;10-[4-[2-(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]phenyl]phenoxazine;10-[3-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine

5-carbazol-9-yl-2,7-bis(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;5-carbazol-9-yl-7-(4-carbazol-9-ylphenyl)-2-(5-carbazol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine;10-[4-[2-(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]phenyl]phenoxazine;10-[3-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine (PubChem CID 161124067) has the molecular formula C173H106N18O2S4 and a molecular weight of 2597.14 g/mol. Its IUPAC name is 5-carbazol-9-yl-2,7-bis(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;5-carbazol-9-yl-7-(4-carbazol-9-ylphenyl)-2-(5-carbazol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine;10-[4-[2-(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]phenyl]phenoxazine;10-[3-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine.

Molecular Properties

Compound Name5-carbazol-9-yl-2,7-bis(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;5-carbazol-9-yl-7-(4-carbazol-9-ylphenyl)-2-(5-carbazol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine;10-[4-[2-(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]phenyl]phenoxazine;10-[3-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine
PubChem CID161124067
Molecular FormulaC173H106N18O2S4
Molecular Weight2597.14 g/mol
Exact Mass2594.76
IUPAC Name5-carbazol-9-yl-2,7-bis(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;5-carbazol-9-yl-7-(4-carbazol-9-ylphenyl)-2-(5-carbazol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine;10-[4-[2-(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]phenyl]phenoxazine;10-[3-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine
SMILESc1cc(-c2nc3ncccc3s2)cc(N2c3ccccc3Oc3ccccc32)c1.c1ccc2c(c1)Oc1ccccc1N2c1ccc(-c2cnc3nc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)sc3c2)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2cc(-n3c4ccccc4c4ccccc43)nc3nc(-c4ccc(-n5c6ccccc6c6ccccc65)cn4)sc23)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2nc3nc(-n4c5ccccc5c5ccccc54)cc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3s2)cc1
InChIInChI=1S/C54H33N5S.C53H32N6S.C42H26N4OS.C24H15N3OS/c1-7-19-45-38(13-1)39-14-2-8-20-46(39)57(45)36-29-25-34(26-30-36)44-33-51(59-49-23-11-5-17-42(49)43-18-6-12-24-50(43)59)55-53-52(44)60-54(56-53)35-27-31-37(32-28-35)58-47-21-9-3-15-40(47)41-16-4-10-22-48(41)58;1-7-19-44-36(13-1)37-14-2-8-20-45(37)57(44)34-27-25-33(26-28-34)42-31-50(59-48-23-11-5-17-40(48)41-18-6-12-24-49(41)59)55-52-51(42)60-53(56-52)43-30-29-35(32-54-43)58-46-21-9-3-15-38(46)39-16-4-10-22-47(39)58;1-3-11-34-32(9-1)33-10-2-4-12-35(33)45(34)30-23-19-28(20-24-30)42-44-41-40(48-42)25-29(26-43-41)27-17-21-31(22-18-27)46-36-13-5-7-15-38(36)47-39-16-8-6-14-37(39)46;1-3-11-20-18(9-1)27(19-10-2-4-12-21(19)28-20)17-8-5-7-16(15-17)24-26-23-22(29-24)13-6-14-25-23/h1-33H;1-32H;1-26H;1-15H
InChIKeyULIBXUYYERWDAJ-UHFFFAOYSA-N
XLogP46.66
TPSA175.46 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds16
Heavy Atoms197
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002597.14
LogP ≤ 546.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Analyze 5-carbazol-9-yl-2,7-bis(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;5-carbazol-9-yl-7-(4-carbazol-9-ylphenyl)-2-(5-carbazol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine;10-[4-[2-(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]phenyl]phenoxazine;10-[3-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine with MolForge

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Related Compounds

9-[4-Carbazol-9-yl-2,6-bis(4-methylphenyl)phenyl]carbazole;9-[4-carbazol-9-yl-2,6-bis(2,3,4,5,6-pentafluorophenyl)phenyl]carbazole;10-[4-phenothiazin-10-yl-2,5-di(pyrimidin-2-yl)phenyl]phenothiazine;10-[4-phenoxazin-10-yl-2,6-bis(trifluoromethyl)phenyl]phenoxazine
CID 159440060
Methane;4-[7-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyridin-3-yl]-7-(trifluoromethyl)quinoline;7-[4-(4-methylpiperazin-1-yl)phenyl]-3-(3-methyl-4-pyridinyl)imidazo[1,2-a]pyridine;7-[4-(4-methylpiperazin-1-yl)phenyl]-3-thiophen-3-ylimidazo[1,2-a]pyridine;7-(4-phenoxyphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine;7-(4-propan-2-yloxyphenyl)-3-pyridin-4-ylimidazo[1,2-a]pyridine
CID 161510294
10-[8-(3,6-Diphenylimidazo[4,5-b]pyridin-2-yl)-3lambda4,7-dithia-2,4-diazabicyclo[3.3.0]octa-1(8),2,3,5-tetraen-6-yl]phenoxazine
CID 10121304
10-[3,5-Bis([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine
CID 129148035
2-(N-[3-[3-phenoxazin-10-yl-5-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]-5-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]anilino)phenol
CID 129148072
10-[2-[2-Phenoxazin-10-yl-4-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]-5-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine
CID 129148095
10-[4-[4-Phenoxazin-10-yl-2-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]-3-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine
CID 129148107
10-[3-[3-Phenoxazin-10-yl-5-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]-5-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine
CID 129148224
10-[2,6-Bis(1-dibenzothiophen-1-ylpyrrolo[2,3-b]pyridin-2-yl)-4-pyridinyl]phenoxazine
CID 137434111
10-[4-[6-(4-Carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridin-2-yl]phenyl]phenoxazine
CID 156218228
10-[4-[2-(4-Carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]phenyl]phenoxazine
CID 156218280
benzene;9H-carbazole;9,9-dimethyl-10H-acridine;9,9-diphenyl-10H-acridine;3-(9H-fluoren-9-yl)pyridine;10H-phenothiazine;10H-phenoxazine;9-phenylcarbazole;pyridine;9H-pyrido[3,4-b]indole;3,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 157072930

Frequently Asked Questions

What is the IUPAC name of 5-carbazol-9-yl-2,7-bis(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;5-carbazol-9-yl-7-(4-carbazol-9-ylphenyl)-2-(5-carbazol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine;10-[4-[2-(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]phenyl]phenoxazine;10-[3-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine?
The IUPAC name of 5-carbazol-9-yl-2,7-bis(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;5-carbazol-9-yl-7-(4-carbazol-9-ylphenyl)-2-(5-carbazol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine;10-[4-[2-(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]phenyl]phenoxazine;10-[3-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine (CID 161124067) is 5-carbazol-9-yl-2,7-bis(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;5-carbazol-9-yl-7-(4-carbazol-9-ylphenyl)-2-(5-carbazol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine;10-[4-[2-(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]phenyl]phenoxazine;10-[3-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine.
What is the SMILES notation for 5-carbazol-9-yl-2,7-bis(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;5-carbazol-9-yl-7-(4-carbazol-9-ylphenyl)-2-(5-carbazol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine;10-[4-[2-(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]phenyl]phenoxazine;10-[3-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine?
The canonical SMILES for 5-carbazol-9-yl-2,7-bis(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;5-carbazol-9-yl-7-(4-carbazol-9-ylphenyl)-2-(5-carbazol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine;10-[4-[2-(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]phenyl]phenoxazine;10-[3-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine is c1cc(-c2nc3ncccc3s2)cc(N2c3ccccc3Oc3ccccc32)c1.c1ccc2c(c1)Oc1ccccc1N2c1ccc(-c2cnc3nc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)sc3c2)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2cc(-n3c4ccccc4c4ccccc43)nc3nc(-c4ccc(-n5c6ccccc6c6ccccc65)cn4)sc23)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2nc3nc(-n4c5ccccc5c5ccccc54)cc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3s2)cc1.
What is the InChIKey of 5-carbazol-9-yl-2,7-bis(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;5-carbazol-9-yl-7-(4-carbazol-9-ylphenyl)-2-(5-carbazol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine;10-[4-[2-(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]phenyl]phenoxazine;10-[3-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine?
The InChIKey is ULIBXUYYERWDAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H33N5S.C53H32N6S.C42H26N4OS.C24H15N3OS/c1-7-19-45-38(13-1)39-14-2-8-20-46(39)57(45)36-29-25-34(26-30-36)44-33-51(59-49-23-11-5-17-42(49)43-18-6-12-24-50(43)59)55-53-52(44)60-54(56-53)35-27-31-37(32-28-35)58-47-21-9-3-15-40(47)41-16-4-10-22-48(41)58;1-7-19-44-36(13-1)37-14-2-8-20-45(37)57(44)34-27-25-33(26-28-34)42-31-50(59-48-23-11-5-17-40(48)41-18-6-12-24-49(41)59)55-52-51(42)60-53(56-52)43-30-29-35(32-54-43)58-46-21-9-3-15-38(46)39-16-4-10-22-47(39)58;1-3-11-34-32(9-1)33-10-2-4-12-35(33)45(34)30-23-19-28(20-24-30)42-44-41-40(48-42)25-29(26-43-41)27-17-21-31(22-18-27)46-36-13-5-7-15-38(36)47-39-16-8-6-14-37(39)46;1-3-11-20-18(9-1)27(19-10-2-4-12-21(19)28-20)17-8-5-7-16(15-17)24-26-23-22(29-24)13-6-14-25-23/h1-33H;1-32H;1-26H;1-15H.
What are the key properties of 5-carbazol-9-yl-2,7-bis(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;5-carbazol-9-yl-7-(4-carbazol-9-ylphenyl)-2-(5-carbazol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine;10-[4-[2-(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]phenyl]phenoxazine;10-[3-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine?
5-carbazol-9-yl-2,7-bis(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;5-carbazol-9-yl-7-(4-carbazol-9-ylphenyl)-2-(5-carbazol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine;10-[4-[2-(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]phenyl]phenoxazine;10-[3-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine has a molecular weight of 2597.14 g/mol, XLogP of 46.66, 16 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 5-carbazol-9-yl-2,7-bis(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;5-carbazol-9-yl-7-(4-carbazol-9-ylphenyl)-2-(5-carbazol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine;10-[4-[2-(4-carbazol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]phenyl]phenoxazine;10-[3-([1,3]thiazolo[4,5-b]pyridin-2-yl)phenyl]phenoxazine is sourced from PubChem (CID 161124067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).