3-carbazol-9-yl-10-methyl-7-phenothiazin-10-ylphenothiazine;9-methyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-methylcarbazol-3-yl)-9-phenylcarbazole;10-methyl-3,7-di(phenothiazin-10-yl)phenothiazine;3-(10-methylphenothiazin-3-yl)-10-phenylphenothiazine

C185H127N13S7 — CID 161232958

IUPAC3-carbazol-9-yl-10-methyl-7-phenothiazin-10-ylphenothiazine;9-methyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-methylcarbazol-3-yl)-9-phenylcarbazole;10-methyl-3,7-di(phenothiazin-10-yl)phenothiazine;3-(10-methylphenothiazin-3-yl)-10-phenylphenothiazine
SMILESCN1c2ccc(N3c4ccccc4Sc4ccccc43)cc2Sc2cc(-n3c4ccccc4c4ccccc43)ccc21.CN1c2ccc(N3c4ccccc4Sc4ccccc43)cc2Sc2cc(N3c4ccccc4Sc4ccccc43)ccc21.CN1c2ccccc2Sc2cc(-c3ccc4c(c3)Sc3ccccc3N4c3ccccc3)ccc21.Cn1c2ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2c2cc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)ccc21.Cn1c2ccccc2c2cc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)ccc21
InChIInChI=1S/C49H33N3.C37H25N3S3.C37H25N3S2.C31H22N2S2.C31H22N2/c1-50-44-24-20-32(34-22-26-48-40(28-34)38-16-8-10-18-46(38)51(48)36-12-4-2-5-13-36)30-42(44)43-31-33(21-25-45(43)50)35-23-27-49-41(29-35)39-17-9-11-19-47(39)52(49)37-14-6-3-7-15-37;1-38-26-20-18-24(39-28-10-2-6-14-32(28)41-33-15-7-3-11-29(33)39)22-36(26)43-37-23-25(19-21-27(37)38)40-30-12-4-8-16-34(30)42-35-17-9-5-13-31(35)40;1-38-30-20-18-24(39-28-12-4-2-10-26(28)27-11-3-5-13-29(27)39)22-36(30)42-37-23-25(19-21-31(37)38)40-32-14-6-8-16-34(32)41-35-17-9-7-15-33(35)40;1-32-24-11-5-7-13-28(24)34-30-19-21(15-17-25(30)32)22-16-18-27-31(20-22)35-29-14-8-6-12-26(29)33(27)23-9-3-2-4-10-23;1-32-28-13-7-5-11-24(28)26-19-21(15-17-29(26)32)22-16-18-31-27(20-22)25-12-6-8-14-30(25)33(31)23-9-3-2-4-10-23/h2-31H,1H3;2-23H,1H3;2-23H,1H3;2-20H,1H3;2-20H,1H3
InChIKeyUYZNOSXYMQOGOL-UHFFFAOYSA-N
MW2756.61 g/mol
LogP53.21
Rot. Bonds12

About 3-carbazol-9-yl-10-methyl-7-phenothiazin-10-ylphenothiazine;9-methyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-methylcarbazol-3-yl)-9-phenylcarbazole;10-methyl-3,7-di(phenothiazin-10-yl)phenothiazine;3-(10-methylphenothiazin-3-yl)-10-phenylphenothiazine

3-carbazol-9-yl-10-methyl-7-phenothiazin-10-ylphenothiazine;9-methyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-methylcarbazol-3-yl)-9-phenylcarbazole;10-methyl-3,7-di(phenothiazin-10-yl)phenothiazine;3-(10-methylphenothiazin-3-yl)-10-phenylphenothiazine (PubChem CID 161232958) has the molecular formula C185H127N13S7 and a molecular weight of 2756.61 g/mol. Its IUPAC name is 3-carbazol-9-yl-10-methyl-7-phenothiazin-10-ylphenothiazine;9-methyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-methylcarbazol-3-yl)-9-phenylcarbazole;10-methyl-3,7-di(phenothiazin-10-yl)phenothiazine;3-(10-methylphenothiazin-3-yl)-10-phenylphenothiazine.

Molecular Properties

Compound Name3-carbazol-9-yl-10-methyl-7-phenothiazin-10-ylphenothiazine;9-methyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-methylcarbazol-3-yl)-9-phenylcarbazole;10-methyl-3,7-di(phenothiazin-10-yl)phenothiazine;3-(10-methylphenothiazin-3-yl)-10-phenylphenothiazine
PubChem CID161232958
Molecular FormulaC185H127N13S7
Molecular Weight2756.61 g/mol
Exact Mass2753.84
IUPAC Name3-carbazol-9-yl-10-methyl-7-phenothiazin-10-ylphenothiazine;9-methyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-methylcarbazol-3-yl)-9-phenylcarbazole;10-methyl-3,7-di(phenothiazin-10-yl)phenothiazine;3-(10-methylphenothiazin-3-yl)-10-phenylphenothiazine
SMILESCN1c2ccc(N3c4ccccc4Sc4ccccc43)cc2Sc2cc(-n3c4ccccc4c4ccccc43)ccc21.CN1c2ccc(N3c4ccccc4Sc4ccccc43)cc2Sc2cc(N3c4ccccc4Sc4ccccc43)ccc21.CN1c2ccccc2Sc2cc(-c3ccc4c(c3)Sc3ccccc3N4c3ccccc3)ccc21.Cn1c2ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2c2cc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)ccc21.Cn1c2ccccc2c2cc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)ccc21
InChIInChI=1S/C49H33N3.C37H25N3S3.C37H25N3S2.C31H22N2S2.C31H22N2/c1-50-44-24-20-32(34-22-26-48-40(28-34)38-16-8-10-18-46(38)51(48)36-12-4-2-5-13-36)30-42(44)43-31-33(21-25-45(43)50)35-23-27-49-41(29-35)39-17-9-11-19-47(39)52(49)37-14-6-3-7-15-37;1-38-26-20-18-24(39-28-10-2-6-14-32(28)41-33-15-7-3-11-29(33)39)22-36(26)43-37-23-25(19-21-27(37)38)40-30-12-4-8-16-34(30)42-35-17-9-5-13-31(35)40;1-38-30-20-18-24(39-28-12-4-2-10-26(28)27-11-3-5-13-29(27)39)22-36(30)42-37-23-25(19-21-31(37)38)40-32-14-6-8-16-34(32)41-35-17-9-7-15-33(35)40;1-32-24-11-5-7-13-28(24)34-30-19-21(15-17-25(30)32)22-16-18-27-31(20-22)35-29-14-8-6-12-26(29)33(27)23-9-3-2-4-10-23;1-32-28-13-7-5-11-24(28)26-19-21(15-17-29(26)32)22-16-18-31-27(20-22)25-12-6-8-14-30(25)33(31)23-9-3-2-4-10-23/h2-31H,1H3;2-23H,1H3;2-23H,1H3;2-20H,1H3;2-20H,1H3
InChIKeyUYZNOSXYMQOGOL-UHFFFAOYSA-N
XLogP53.21
TPSA52.26 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds12
Heavy Atoms205
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002756.61
LogP ≤ 553.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze 3-carbazol-9-yl-10-methyl-7-phenothiazin-10-ylphenothiazine;9-methyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-methylcarbazol-3-yl)-9-phenylcarbazole;10-methyl-3,7-di(phenothiazin-10-yl)phenothiazine;3-(10-methylphenothiazin-3-yl)-10-phenylphenothiazine with MolForge

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Related Compounds

10-(6-carbazol-9-yl-9-methylcarbazol-3-yl)phenothiazine;3-carbazol-9-yl-10-methylphenothiazine;3-carbazol-9-yl-10-methyl-7-phenothiazin-10-ylphenothiazine;3,7-di(carbazol-9-yl)-10-methylphenothiazine;9-methyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;10-(9-methylcarbazol-3-yl)phenothiazine;3-(9-methylcarbazol-3-yl)-9-phenylcarbazole;10-methyl-3,7-di(phenothiazin-10-yl)phenothiazine;10-(9-methyl-6-phenothiazin-10-ylcarbazol-3-yl)phenothiazine;3-(10-methylphenothiazin-3-yl)-10-phenylphenothiazine
CID 159798260
3,6-bis(4-carbazol-9-ylphenyl)-9-methylcarbazole;3-(4-carbazol-9-ylphenyl)-9-methylcarbazole;10-methyl-3,7-bis(9-phenylcarbazol-3-yl)phenothiazine;10-methyl-3,7-bis(10-phenylphenothiazin-3-yl)phenothiazine;3-[9-methyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]-10-phenylphenothiazine;10-methyl-3-(9-phenylcarbazol-3-yl)-7-(10-phenylphenothiazin-3-yl)phenothiazine
CID 159664393
3,7-bis(4-carbazol-9-ylphenyl)-10-methylphenothiazine;3-(4-carbazol-9-ylphenyl)-10-methylphenothiazine;3-(4-carbazol-9-ylphenyl)-10-methyl-7-(4-phenothiazin-10-ylphenyl)phenothiazine;10-methyl-3,7-bis(4-phenothiazin-10-ylphenyl)phenothiazine;10-methyl-3-(4-phenothiazin-10-ylphenyl)phenothiazine
CID 159482320
10-(3-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]phenothiazine
CID 134476408
10-phenyl-3-[4-[9-(3-phenylphenyl)carbazol-3-yl]phenyl]phenothiazine
CID 134476436
10-[4-[6-(4-phenothiazin-10-ylphenyl)-9-phenylcarbazol-3-yl]phenyl]phenothiazine
CID 137467162
10-naphthalen-2-yl-3-(9-naphthalen-2-ylcarbazol-3-yl)phenothiazine
CID 134476041
3-[9-(9,9-dimethylfluoren-3-yl)carbazol-3-yl]-10-phenylphenothiazine
CID 134475698
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-10-(3-phenylphenyl)phenothiazine
CID 134475884
3,7-di(carbazol-9-yl)-10-(11-phenyltriphenylen-2-yl)phenothiazine
CID 121475719
10-(3-phenylphenyl)-3-[3-(9-triphenylen-2-ylcarbazol-2-yl)phenyl]phenothiazine
CID 134475869
1-phenyl-10-[2-(9-phenylcarbazol-3-yl)-4-(1-phenylpyrrolo[2,3-b]phenothiazin-10-yl)phenyl]pyrrolo[2,3-b]phenothiazine
CID 155121199

Frequently Asked Questions

What is the IUPAC name of 3-carbazol-9-yl-10-methyl-7-phenothiazin-10-ylphenothiazine;9-methyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-methylcarbazol-3-yl)-9-phenylcarbazole;10-methyl-3,7-di(phenothiazin-10-yl)phenothiazine;3-(10-methylphenothiazin-3-yl)-10-phenylphenothiazine?
The IUPAC name of 3-carbazol-9-yl-10-methyl-7-phenothiazin-10-ylphenothiazine;9-methyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-methylcarbazol-3-yl)-9-phenylcarbazole;10-methyl-3,7-di(phenothiazin-10-yl)phenothiazine;3-(10-methylphenothiazin-3-yl)-10-phenylphenothiazine (CID 161232958) is 3-carbazol-9-yl-10-methyl-7-phenothiazin-10-ylphenothiazine;9-methyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-methylcarbazol-3-yl)-9-phenylcarbazole;10-methyl-3,7-di(phenothiazin-10-yl)phenothiazine;3-(10-methylphenothiazin-3-yl)-10-phenylphenothiazine.
What is the SMILES notation for 3-carbazol-9-yl-10-methyl-7-phenothiazin-10-ylphenothiazine;9-methyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-methylcarbazol-3-yl)-9-phenylcarbazole;10-methyl-3,7-di(phenothiazin-10-yl)phenothiazine;3-(10-methylphenothiazin-3-yl)-10-phenylphenothiazine?
The canonical SMILES for 3-carbazol-9-yl-10-methyl-7-phenothiazin-10-ylphenothiazine;9-methyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-methylcarbazol-3-yl)-9-phenylcarbazole;10-methyl-3,7-di(phenothiazin-10-yl)phenothiazine;3-(10-methylphenothiazin-3-yl)-10-phenylphenothiazine is CN1c2ccc(N3c4ccccc4Sc4ccccc43)cc2Sc2cc(-n3c4ccccc4c4ccccc43)ccc21.CN1c2ccc(N3c4ccccc4Sc4ccccc43)cc2Sc2cc(N3c4ccccc4Sc4ccccc43)ccc21.CN1c2ccccc2Sc2cc(-c3ccc4c(c3)Sc3ccccc3N4c3ccccc3)ccc21.Cn1c2ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2c2cc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)ccc21.Cn1c2ccccc2c2cc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)ccc21.
What is the InChIKey of 3-carbazol-9-yl-10-methyl-7-phenothiazin-10-ylphenothiazine;9-methyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-methylcarbazol-3-yl)-9-phenylcarbazole;10-methyl-3,7-di(phenothiazin-10-yl)phenothiazine;3-(10-methylphenothiazin-3-yl)-10-phenylphenothiazine?
The InChIKey is UYZNOSXYMQOGOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H33N3.C37H25N3S3.C37H25N3S2.C31H22N2S2.C31H22N2/c1-50-44-24-20-32(34-22-26-48-40(28-34)38-16-8-10-18-46(38)51(48)36-12-4-2-5-13-36)30-42(44)43-31-33(21-25-45(43)50)35-23-27-49-41(29-35)39-17-9-11-19-47(39)52(49)37-14-6-3-7-15-37;1-38-26-20-18-24(39-28-10-2-6-14-32(28)41-33-15-7-3-11-29(33)39)22-36(26)43-37-23-25(19-21-27(37)38)40-30-12-4-8-16-34(30)42-35-17-9-5-13-31(35)40;1-38-30-20-18-24(39-28-12-4-2-10-26(28)27-11-3-5-13-29(27)39)22-36(30)42-37-23-25(19-21-31(37)38)40-32-14-6-8-16-34(32)41-35-17-9-7-15-33(35)40;1-32-24-11-5-7-13-28(24)34-30-19-21(15-17-25(30)32)22-16-18-27-31(20-22)35-29-14-8-6-12-26(29)33(27)23-9-3-2-4-10-23;1-32-28-13-7-5-11-24(28)26-19-21(15-17-29(26)32)22-16-18-31-27(20-22)25-12-6-8-14-30(25)33(31)23-9-3-2-4-10-23/h2-31H,1H3;2-23H,1H3;2-23H,1H3;2-20H,1H3;2-20H,1H3.
What are the key properties of 3-carbazol-9-yl-10-methyl-7-phenothiazin-10-ylphenothiazine;9-methyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-methylcarbazol-3-yl)-9-phenylcarbazole;10-methyl-3,7-di(phenothiazin-10-yl)phenothiazine;3-(10-methylphenothiazin-3-yl)-10-phenylphenothiazine?
3-carbazol-9-yl-10-methyl-7-phenothiazin-10-ylphenothiazine;9-methyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-methylcarbazol-3-yl)-9-phenylcarbazole;10-methyl-3,7-di(phenothiazin-10-yl)phenothiazine;3-(10-methylphenothiazin-3-yl)-10-phenylphenothiazine has a molecular weight of 2756.61 g/mol, XLogP of 53.21, 12 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 3-carbazol-9-yl-10-methyl-7-phenothiazin-10-ylphenothiazine;9-methyl-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-methylcarbazol-3-yl)-9-phenylcarbazole;10-methyl-3,7-di(phenothiazin-10-yl)phenothiazine;3-(10-methylphenothiazin-3-yl)-10-phenylphenothiazine is sourced from PubChem (CID 161232958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).