10-(4-dibenzofuran-2-ylnaphthalen-1-yl)-3,7-diphenylphenothiazine;10-(4-dibenzofuran-2-ylnaphthalen-1-yl)phenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-methyl-7-phenylphenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-naphthalen-1-yl-7-phenylphenothiazine

C175H112N4O4S4 — CID 160914738

IUPAC10-(4-dibenzofuran-2-ylnaphthalen-1-yl)-3,7-diphenylphenothiazine;10-(4-dibenzofuran-2-ylnaphthalen-1-yl)phenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-methyl-7-phenylphenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-naphthalen-1-yl-7-phenylphenothiazine
SMILESCc1ccc2c(c1)Sc1cc(-c3ccccc3)ccc1N2c1ccc(-c2ccc(-c3ccc4oc5ccccc5c4c3)cc2)cc1.c1ccc(-c2ccc3c(c2)Sc2cc(-c4cccc5ccccc45)ccc2N3c2ccc(-c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)cc2)cc1.c1ccc(-c2ccc3c(c2)Sc2cc(-c4ccccc4)ccc2N3c2ccc(-c3ccc4oc5ccccc5c4c3)c3ccccc23)cc1.c1ccc2c(c1)Sc1ccccc1N2c1ccc(-c2ccc3oc4ccccc4c3c2)c2ccccc12
InChIInChI=1S/C52H33NOS.C46H29NOS.C43H29NOS.C34H21NOS/c1-2-9-34(10-3-1)40-23-28-47-51(32-40)55-52-33-41(44-15-8-12-38-11-4-5-13-43(38)44)24-29-48(52)53(47)42-26-21-36(22-27-42)35-17-19-37(20-18-35)39-25-30-50-46(31-39)45-14-6-7-16-49(45)54-50;1-3-11-30(12-4-1)32-19-23-41-45(28-32)49-46-29-33(31-13-5-2-6-14-31)20-24-42(46)47(41)40-25-22-35(36-15-7-8-16-37(36)40)34-21-26-44-39(27-34)38-17-9-10-18-43(38)48-44;1-28-11-22-38-42(25-28)46-43-27-34(29-7-3-2-4-8-29)18-23-39(43)44(38)35-20-16-31(17-21-35)30-12-14-32(15-13-30)33-19-24-41-37(26-33)36-9-5-6-10-40(36)45-41;1-2-10-25-24(9-1)23(22-17-20-32-27(21-22)26-11-3-6-14-31(26)36-32)18-19-28(25)35-29-12-4-7-15-33(29)37-34-16-8-5-13-30(34)35/h1-33H;1-29H;2-27H,1H3;1-21H
InChIKeySRGFKVLXMJPVAK-UHFFFAOYSA-N
MW2463.11 g/mol
LogP52.19
Rot. Bonds15

About 10-(4-dibenzofuran-2-ylnaphthalen-1-yl)-3,7-diphenylphenothiazine;10-(4-dibenzofuran-2-ylnaphthalen-1-yl)phenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-methyl-7-phenylphenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-naphthalen-1-yl-7-phenylphenothiazine

10-(4-dibenzofuran-2-ylnaphthalen-1-yl)-3,7-diphenylphenothiazine;10-(4-dibenzofuran-2-ylnaphthalen-1-yl)phenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-methyl-7-phenylphenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-naphthalen-1-yl-7-phenylphenothiazine (PubChem CID 160914738) has the molecular formula C175H112N4O4S4 and a molecular weight of 2463.11 g/mol. Its IUPAC name is 10-(4-dibenzofuran-2-ylnaphthalen-1-yl)-3,7-diphenylphenothiazine;10-(4-dibenzofuran-2-ylnaphthalen-1-yl)phenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-methyl-7-phenylphenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-naphthalen-1-yl-7-phenylphenothiazine.

Molecular Properties

Compound Name10-(4-dibenzofuran-2-ylnaphthalen-1-yl)-3,7-diphenylphenothiazine;10-(4-dibenzofuran-2-ylnaphthalen-1-yl)phenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-methyl-7-phenylphenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-naphthalen-1-yl-7-phenylphenothiazine
PubChem CID160914738
Molecular FormulaC175H112N4O4S4
Molecular Weight2463.11 g/mol
Exact Mass2460.76
IUPAC Name10-(4-dibenzofuran-2-ylnaphthalen-1-yl)-3,7-diphenylphenothiazine;10-(4-dibenzofuran-2-ylnaphthalen-1-yl)phenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-methyl-7-phenylphenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-naphthalen-1-yl-7-phenylphenothiazine
SMILESCc1ccc2c(c1)Sc1cc(-c3ccccc3)ccc1N2c1ccc(-c2ccc(-c3ccc4oc5ccccc5c4c3)cc2)cc1.c1ccc(-c2ccc3c(c2)Sc2cc(-c4cccc5ccccc45)ccc2N3c2ccc(-c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)cc2)cc1.c1ccc(-c2ccc3c(c2)Sc2cc(-c4ccccc4)ccc2N3c2ccc(-c3ccc4oc5ccccc5c4c3)c3ccccc23)cc1.c1ccc2c(c1)Sc1ccccc1N2c1ccc(-c2ccc3oc4ccccc4c3c2)c2ccccc12
InChIInChI=1S/C52H33NOS.C46H29NOS.C43H29NOS.C34H21NOS/c1-2-9-34(10-3-1)40-23-28-47-51(32-40)55-52-33-41(44-15-8-12-38-11-4-5-13-43(38)44)24-29-48(52)53(47)42-26-21-36(22-27-42)35-17-19-37(20-18-35)39-25-30-50-46(31-39)45-14-6-7-16-49(45)54-50;1-3-11-30(12-4-1)32-19-23-41-45(28-32)49-46-29-33(31-13-5-2-6-14-31)20-24-42(46)47(41)40-25-22-35(36-15-7-8-16-37(36)40)34-21-26-44-39(27-34)38-17-9-10-18-43(38)48-44;1-28-11-22-38-42(25-28)46-43-27-34(29-7-3-2-4-8-29)18-23-39(43)44(38)35-20-16-31(17-21-35)30-12-14-32(15-13-30)33-19-24-41-37(26-33)36-9-5-6-10-40(36)45-41;1-2-10-25-24(9-1)23(22-17-20-32-27(21-22)26-11-3-6-14-31(26)36-32)18-19-28(25)35-29-12-4-7-15-33(29)37-34-16-8-5-13-30(34)35/h1-33H;1-29H;2-27H,1H3;1-21H
InChIKeySRGFKVLXMJPVAK-UHFFFAOYSA-N
XLogP52.19
TPSA65.52 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds15
Heavy Atoms187
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002463.11
LogP ≤ 552.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 10-(4-dibenzofuran-2-ylnaphthalen-1-yl)-3,7-diphenylphenothiazine;10-(4-dibenzofuran-2-ylnaphthalen-1-yl)phenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-methyl-7-phenylphenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-naphthalen-1-yl-7-phenylphenothiazine with MolForge

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Related Compounds

3-(4-dibenzofuran-2-ylquinolin-2-yl)-10-(4-phenylphenyl)phenothiazine
CID 147850677
10-(7-dibenzothiophen-4-yl-9,9-dimethylfluoren-2-yl)-3,7-dimethylphenothiazine;10-(4-dibenzothiophen-4-ylnaphthalen-1-yl)-3,7-diphenylphenothiazine;10-(4-dibenzothiophen-4-ylnaphthalen-1-yl)phenothiazine;10-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-3-naphthalen-1-yl-7-phenylphenothiazine
CID 159335106
3-dibenzofuran-2-yl-7-fluoro-10-(4-phenylphenyl)phenothiazine
CID 71003998
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-10-(3-phenylphenyl)phenothiazine
CID 134475884
1-chloro-7-dibenzofuran-2-yl-10-naphthalen-1-ylphenothiazine
CID 153305766
10-[4-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]phenothiazine;10-[4-[4-(4,6-diphenylpyrimidin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenothiazine;10-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenothiazine
CID 159949835
10-dibenzofuran-4-yl-3-(9-dibenzofuran-2-ylcarbazol-3-yl)phenothiazine
CID 134475813
10-[9-(4-methylphenyl)-10-naphthalen-1-yl-6-phenothiazin-10-ylanthracen-2-yl]phenothiazine
CID 59220855
N-(4-carbazol-9-ylphenyl)-N-[4-(10-phenylphenothiazin-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(10-phenylphenothiazin-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(10-phenylphenothiazin-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-[4-(10-phenylphenothiazin-3-yl)phenyl]naphthalen-1-amine;N-naphthalen-1-yl-10-phenyl-N-[4-(10-phenylphenothiazin-3-yl)phenyl]phenoxazin-3-amine;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[4-(10-phenylphenothiazin-3-yl)phenyl]naphthalen-1-amine
CID 159537331
10-[4-[4-(4-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenothiazine
CID 118528475
9-(3-naphthalen-1-ylphenyl)-10-(7-phenylnaphthalen-1-yl)anthracene;2-[2-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]phenyl]dibenzofuran;2-[3-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]phenyl]dibenzofuran;2-[4-[10-(7-phenylnaphthalen-1-yl)anthracen-9-yl]phenyl]dibenzofuran
CID 165000959
2-(8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)dibenzofuran
CID 177297853

Frequently Asked Questions

What is the IUPAC name of 10-(4-dibenzofuran-2-ylnaphthalen-1-yl)-3,7-diphenylphenothiazine;10-(4-dibenzofuran-2-ylnaphthalen-1-yl)phenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-methyl-7-phenylphenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-naphthalen-1-yl-7-phenylphenothiazine?
The IUPAC name of 10-(4-dibenzofuran-2-ylnaphthalen-1-yl)-3,7-diphenylphenothiazine;10-(4-dibenzofuran-2-ylnaphthalen-1-yl)phenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-methyl-7-phenylphenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-naphthalen-1-yl-7-phenylphenothiazine (CID 160914738) is 10-(4-dibenzofuran-2-ylnaphthalen-1-yl)-3,7-diphenylphenothiazine;10-(4-dibenzofuran-2-ylnaphthalen-1-yl)phenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-methyl-7-phenylphenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-naphthalen-1-yl-7-phenylphenothiazine.
What is the SMILES notation for 10-(4-dibenzofuran-2-ylnaphthalen-1-yl)-3,7-diphenylphenothiazine;10-(4-dibenzofuran-2-ylnaphthalen-1-yl)phenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-methyl-7-phenylphenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-naphthalen-1-yl-7-phenylphenothiazine?
The canonical SMILES for 10-(4-dibenzofuran-2-ylnaphthalen-1-yl)-3,7-diphenylphenothiazine;10-(4-dibenzofuran-2-ylnaphthalen-1-yl)phenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-methyl-7-phenylphenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-naphthalen-1-yl-7-phenylphenothiazine is Cc1ccc2c(c1)Sc1cc(-c3ccccc3)ccc1N2c1ccc(-c2ccc(-c3ccc4oc5ccccc5c4c3)cc2)cc1.c1ccc(-c2ccc3c(c2)Sc2cc(-c4cccc5ccccc45)ccc2N3c2ccc(-c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)cc2)cc1.c1ccc(-c2ccc3c(c2)Sc2cc(-c4ccccc4)ccc2N3c2ccc(-c3ccc4oc5ccccc5c4c3)c3ccccc23)cc1.c1ccc2c(c1)Sc1ccccc1N2c1ccc(-c2ccc3oc4ccccc4c3c2)c2ccccc12.
What is the InChIKey of 10-(4-dibenzofuran-2-ylnaphthalen-1-yl)-3,7-diphenylphenothiazine;10-(4-dibenzofuran-2-ylnaphthalen-1-yl)phenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-methyl-7-phenylphenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-naphthalen-1-yl-7-phenylphenothiazine?
The InChIKey is SRGFKVLXMJPVAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H33NOS.C46H29NOS.C43H29NOS.C34H21NOS/c1-2-9-34(10-3-1)40-23-28-47-51(32-40)55-52-33-41(44-15-8-12-38-11-4-5-13-43(38)44)24-29-48(52)53(47)42-26-21-36(22-27-42)35-17-19-37(20-18-35)39-25-30-50-46(31-39)45-14-6-7-16-49(45)54-50;1-3-11-30(12-4-1)32-19-23-41-45(28-32)49-46-29-33(31-13-5-2-6-14-31)20-24-42(46)47(41)40-25-22-35(36-15-7-8-16-37(36)40)34-21-26-44-39(27-34)38-17-9-10-18-43(38)48-44;1-28-11-22-38-42(25-28)46-43-27-34(29-7-3-2-4-8-29)18-23-39(43)44(38)35-20-16-31(17-21-35)30-12-14-32(15-13-30)33-19-24-41-37(26-33)36-9-5-6-10-40(36)45-41;1-2-10-25-24(9-1)23(22-17-20-32-27(21-22)26-11-3-6-14-31(26)36-32)18-19-28(25)35-29-12-4-7-15-33(29)37-34-16-8-5-13-30(34)35/h1-33H;1-29H;2-27H,1H3;1-21H.
What are the key properties of 10-(4-dibenzofuran-2-ylnaphthalen-1-yl)-3,7-diphenylphenothiazine;10-(4-dibenzofuran-2-ylnaphthalen-1-yl)phenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-methyl-7-phenylphenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-naphthalen-1-yl-7-phenylphenothiazine?
10-(4-dibenzofuran-2-ylnaphthalen-1-yl)-3,7-diphenylphenothiazine;10-(4-dibenzofuran-2-ylnaphthalen-1-yl)phenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-methyl-7-phenylphenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-naphthalen-1-yl-7-phenylphenothiazine has a molecular weight of 2463.11 g/mol, XLogP of 52.19, 15 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(4-dibenzofuran-2-ylnaphthalen-1-yl)-3,7-diphenylphenothiazine;10-(4-dibenzofuran-2-ylnaphthalen-1-yl)phenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-methyl-7-phenylphenothiazine;10-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-3-naphthalen-1-yl-7-phenylphenothiazine is sourced from PubChem (CID 160914738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).