N-dibenzothiophen-2-yl-10-dibenzothiophen-3-yl-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-(9,9-dimethylfluoren-3-yl)-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-naphthalen-1-yl-N-(3-phenylphenyl)phenoxazin-3-amine

C141H92N6O3S4 — CID 165105763

IUPACN-dibenzothiophen-2-yl-10-dibenzothiophen-3-yl-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-(9,9-dimethylfluoren-3-yl)-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-naphthalen-1-yl-N-(3-phenylphenyl)phenoxazin-3-amine
SMILESCC1(C)c2ccccc2-c2cc(N(c3ccc4c(c3)Oc3ccccc3N4c3ccc4c(c3)sc3ccccc34)c3cccc4ccccc34)ccc21.c1ccc(-c2cccc(N(c3ccc4c(c3)Oc3ccccc3N4c3ccc4c(c3)sc3ccccc34)c3cccc4ccccc34)c2)cc1.c1ccc2c(c1)Oc1cc(N(c3ccc4sc5ccccc5c4c3)c3cccc4ccccc34)ccc1N2c1ccc2c(c1)sc1ccccc12
InChIInChI=1S/C49H34N2OS.C46H28N2OS2.C46H30N2OS/c1-49(2)40-17-7-5-15-36(40)39-28-32(23-26-41(39)49)50(42-19-11-13-31-12-3-4-14-35(31)42)33-24-27-44-46(29-33)52-45-20-9-8-18-43(45)51(44)34-22-25-38-37-16-6-10-21-47(37)53-48(38)30-34;1-2-12-33-29(10-1)11-9-16-38(33)47(30-22-25-45-37(26-30)35-14-4-8-19-44(35)50-45)31-21-24-40-42(27-31)49-41-17-6-5-15-39(41)48(40)32-20-23-36-34-13-3-7-18-43(34)51-46(36)28-32;1-2-12-31(13-3-1)33-16-10-17-34(28-33)47(40-21-11-15-32-14-4-5-18-37(32)40)35-25-27-42-44(29-35)49-43-22-8-7-20-41(43)48(42)36-24-26-39-38-19-6-9-23-45(38)50-46(39)30-36/h3-30H,1-2H3;1-28H;1-30H
InChIKeyZCDZWYLCXFDLRU-UHFFFAOYSA-N
MW2046.59 g/mol
LogP43.10
Rot. Bonds13

About N-dibenzothiophen-2-yl-10-dibenzothiophen-3-yl-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-(9,9-dimethylfluoren-3-yl)-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-naphthalen-1-yl-N-(3-phenylphenyl)phenoxazin-3-amine

N-dibenzothiophen-2-yl-10-dibenzothiophen-3-yl-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-(9,9-dimethylfluoren-3-yl)-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-naphthalen-1-yl-N-(3-phenylphenyl)phenoxazin-3-amine (PubChem CID 165105763) has the molecular formula C141H92N6O3S4 and a molecular weight of 2046.59 g/mol. Its IUPAC name is N-dibenzothiophen-2-yl-10-dibenzothiophen-3-yl-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-(9,9-dimethylfluoren-3-yl)-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-naphthalen-1-yl-N-(3-phenylphenyl)phenoxazin-3-amine.

Molecular Properties

Compound NameN-dibenzothiophen-2-yl-10-dibenzothiophen-3-yl-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-(9,9-dimethylfluoren-3-yl)-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-naphthalen-1-yl-N-(3-phenylphenyl)phenoxazin-3-amine
PubChem CID165105763
Molecular FormulaC141H92N6O3S4
Molecular Weight2046.59 g/mol
Exact Mass2044.61
IUPAC NameN-dibenzothiophen-2-yl-10-dibenzothiophen-3-yl-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-(9,9-dimethylfluoren-3-yl)-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-naphthalen-1-yl-N-(3-phenylphenyl)phenoxazin-3-amine
SMILESCC1(C)c2ccccc2-c2cc(N(c3ccc4c(c3)Oc3ccccc3N4c3ccc4c(c3)sc3ccccc34)c3cccc4ccccc34)ccc21.c1ccc(-c2cccc(N(c3ccc4c(c3)Oc3ccccc3N4c3ccc4c(c3)sc3ccccc34)c3cccc4ccccc34)c2)cc1.c1ccc2c(c1)Oc1cc(N(c3ccc4sc5ccccc5c4c3)c3cccc4ccccc34)ccc1N2c1ccc2c(c1)sc1ccccc12
InChIInChI=1S/C49H34N2OS.C46H28N2OS2.C46H30N2OS/c1-49(2)40-17-7-5-15-36(40)39-28-32(23-26-41(39)49)50(42-19-11-13-31-12-3-4-14-35(31)42)33-24-27-44-46(29-33)52-45-20-9-8-18-43(45)51(44)34-22-25-38-37-16-6-10-21-47(37)53-48(38)30-34;1-2-12-33-29(10-1)11-9-16-38(33)47(30-22-25-45-37(26-30)35-14-4-8-19-44(35)50-45)31-21-24-40-42(27-31)49-41-17-6-5-15-39(41)48(40)32-20-23-36-34-13-3-7-18-43(34)51-46(36)28-32;1-2-12-31(13-3-1)33-16-10-17-34(28-33)47(40-21-11-15-32-14-4-5-18-37(32)40)35-25-27-42-44(29-35)49-43-22-8-7-20-41(43)48(42)36-24-26-39-38-19-6-9-23-45(38)50-46(39)30-36/h3-30H,1-2H3;1-28H;1-30H
InChIKeyZCDZWYLCXFDLRU-UHFFFAOYSA-N
XLogP43.10
TPSA47.13 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds13
Heavy Atoms154
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002046.59
LogP ≤ 543.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Analyze N-dibenzothiophen-2-yl-10-dibenzothiophen-3-yl-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-(9,9-dimethylfluoren-3-yl)-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-naphthalen-1-yl-N-(3-phenylphenyl)phenoxazin-3-amine with MolForge

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Related Compounds

10-dibenzothiophen-3-yl-N-(9,9-dimethylfluoren-2-yl)-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-(4-naphthalen-2-ylphenyl)-N-phenylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-phenanthren-2-yl-N-phenylphenoxazin-3-amine
CID 164975730
10-dibenzothiophen-3-yl-N-(3-phenylphenyl)-N-(4-phenylphenyl)phenoxazin-3-amine
CID 164811783
N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-3-phenyl-N-(3-phenylphenyl)aniline;N-[4-[4-(N-dibenzothiophen-3-ylanilino)phenyl]phenyl]-N-phenyldibenzothiophen-3-amine;2-N,8-N-dinaphthalen-1-yl-2-N,8-N-diphenyldibenzothiophene-2,8-diamine;N-[4-[4-(3,6-diphenylcarbazol-9-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;4-phenyl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 158464219
7-N-[8-(N-(9,9-dimethylfluoren-3-yl)-4-phenylanilino)dibenzothiophen-3-yl]-2-N,2-N,7-N-triphenyldibenzothiophene-2,7-diamine;2-N,2-N-diphenyl-7-N-(4-phenylphenyl)-7-N-[8-(N-(4-phenylphenyl)anilino)dibenzothiophen-3-yl]dibenzothiophene-2,7-diamine
CID 157158501
7-N-dibenzothiophen-2-yl-9-N-(9,9-dimethylfluoren-2-yl)-6,6,12,12-tetramethyl-2-N-naphthalen-1-yl-7-N,9-N-diphenyl-2-N-(4-phenylphenyl)indeno[2,1-h]fluorene-2,7,9-triamine
CID 155095534
N-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]-3-phenylaniline
CID 168839480
7-N-(11,11-dimethylbenzo[h]fluoren-1-yl)-2-N,7-N-diphenyl-2-N-(3-phenylphenyl)dibenzothiophene-2,7-diamine
CID 170410183
N,N-bis(4-phenylphenyl)-3-(9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16(21),17,19-decaen-19-yl)aniline;N-(9,9-dimethylfluoren-3-yl)-N-(2-phenylphenyl)-9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16(21),17,19-decaen-19-amine;4-phenyl-N-(4-phenylphenyl)-N-[4-(9-thiapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16(21),17,19-decaen-19-yl)phenyl]aniline
CID 162033324
2-dibenzothiophen-3-yl-N-[3-[3-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-N-(3-phenylphenyl)aniline
CID 168839739
N-(11,11-dimethylbenzo[b]fluoren-9-yl)-N-phenyldibenzothiophen-3-amine
CID 156554191
N-dibenzothiophen-3-yl-N-(9,9-dimethylfluoren-3-yl)naphtho[2,1-b][1]benzothiol-4-amine
CID 170044692
N-[4-(9,9-dimethylacridin-10-yl)-9,9'-spirobi[fluorene]-2'-yl]-N-phenyldibenzothiophen-3-amine;N-(9,9-dimethylfluoren-2-yl)-2'-phenoxazin-10-yl-N-phenyl-9,9'-spirobi[fluorene]-4-amine;4-phenothiazin-10-yl-N-phenyl-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2'-amine;2'-phenoxazin-10-yl-N,N-diphenyl-9,9'-spirobi[fluorene]-4-amine
CID 160695196

Frequently Asked Questions

What is the IUPAC name of N-dibenzothiophen-2-yl-10-dibenzothiophen-3-yl-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-(9,9-dimethylfluoren-3-yl)-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-naphthalen-1-yl-N-(3-phenylphenyl)phenoxazin-3-amine?
The IUPAC name of N-dibenzothiophen-2-yl-10-dibenzothiophen-3-yl-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-(9,9-dimethylfluoren-3-yl)-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-naphthalen-1-yl-N-(3-phenylphenyl)phenoxazin-3-amine (CID 165105763) is N-dibenzothiophen-2-yl-10-dibenzothiophen-3-yl-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-(9,9-dimethylfluoren-3-yl)-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-naphthalen-1-yl-N-(3-phenylphenyl)phenoxazin-3-amine.
What is the SMILES notation for N-dibenzothiophen-2-yl-10-dibenzothiophen-3-yl-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-(9,9-dimethylfluoren-3-yl)-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-naphthalen-1-yl-N-(3-phenylphenyl)phenoxazin-3-amine?
The canonical SMILES for N-dibenzothiophen-2-yl-10-dibenzothiophen-3-yl-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-(9,9-dimethylfluoren-3-yl)-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-naphthalen-1-yl-N-(3-phenylphenyl)phenoxazin-3-amine is CC1(C)c2ccccc2-c2cc(N(c3ccc4c(c3)Oc3ccccc3N4c3ccc4c(c3)sc3ccccc34)c3cccc4ccccc34)ccc21.c1ccc(-c2cccc(N(c3ccc4c(c3)Oc3ccccc3N4c3ccc4c(c3)sc3ccccc34)c3cccc4ccccc34)c2)cc1.c1ccc2c(c1)Oc1cc(N(c3ccc4sc5ccccc5c4c3)c3cccc4ccccc34)ccc1N2c1ccc2c(c1)sc1ccccc12.
What is the InChIKey of N-dibenzothiophen-2-yl-10-dibenzothiophen-3-yl-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-(9,9-dimethylfluoren-3-yl)-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-naphthalen-1-yl-N-(3-phenylphenyl)phenoxazin-3-amine?
The InChIKey is ZCDZWYLCXFDLRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H34N2OS.C46H28N2OS2.C46H30N2OS/c1-49(2)40-17-7-5-15-36(40)39-28-32(23-26-41(39)49)50(42-19-11-13-31-12-3-4-14-35(31)42)33-24-27-44-46(29-33)52-45-20-9-8-18-43(45)51(44)34-22-25-38-37-16-6-10-21-47(37)53-48(38)30-34;1-2-12-33-29(10-1)11-9-16-38(33)47(30-22-25-45-37(26-30)35-14-4-8-19-44(35)50-45)31-21-24-40-42(27-31)49-41-17-6-5-15-39(41)48(40)32-20-23-36-34-13-3-7-18-43(34)51-46(36)28-32;1-2-12-31(13-3-1)33-16-10-17-34(28-33)47(40-21-11-15-32-14-4-5-18-37(32)40)35-25-27-42-44(29-35)49-43-22-8-7-20-41(43)48(42)36-24-26-39-38-19-6-9-23-45(38)50-46(39)30-36/h3-30H,1-2H3;1-28H;1-30H.
What are the key properties of N-dibenzothiophen-2-yl-10-dibenzothiophen-3-yl-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-(9,9-dimethylfluoren-3-yl)-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-naphthalen-1-yl-N-(3-phenylphenyl)phenoxazin-3-amine?
N-dibenzothiophen-2-yl-10-dibenzothiophen-3-yl-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-(9,9-dimethylfluoren-3-yl)-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-naphthalen-1-yl-N-(3-phenylphenyl)phenoxazin-3-amine has a molecular weight of 2046.59 g/mol, XLogP of 43.10, 13 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzothiophen-2-yl-10-dibenzothiophen-3-yl-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-(9,9-dimethylfluoren-3-yl)-N-naphthalen-1-ylphenoxazin-3-amine;10-dibenzothiophen-3-yl-N-naphthalen-1-yl-N-(3-phenylphenyl)phenoxazin-3-amine is sourced from PubChem (CID 165105763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).