N,N-bis(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-1-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine

C200H133N5S3 — CID 160770802

IUPACN,N-bis(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-1-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine
SMILESc1cc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3ccc4c(c3)sc3ccccc34)cc2)cc(-c2ccc3ccccc3c2)c1.c1cc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3ccc4c(c3)sc3ccccc34)cc2)cc(-c2cccc3ccccc23)c1.c1cc(-c2ccc(N(c3ccc(-c4cccc5ccccc45)cc3)c3ccc4c(c3)sc3ccccc34)cc2)cc(-c2ccc3ccccc3c2)c1.c1ccc(-n2c3ccccc3c3c(N(c4ccc(-c5cccc6ccccc56)cc4)c4ccc(-c5cccc6ccccc56)cc4)cccc32)cc1
InChIInChI=1S/C50H34N2.3C50H33NS/c1-2-17-39(18-3-1)52-47-24-9-8-21-46(47)50-48(25-12-26-49(50)52)51(40-31-27-37(28-32-40)44-22-10-15-35-13-4-6-19-42(35)44)41-33-29-38(30-34-41)45-23-11-16-36-14-5-7-20-43(36)45;1-3-10-38-31-42(18-16-34(38)8-1)37-22-26-45(27-23-37)51(46-28-29-48-47-14-5-6-15-49(47)52-50(48)33-46)44-24-20-36(21-25-44)40-12-7-13-41(30-40)43-19-17-35-9-2-4-11-39(35)32-43;1-2-11-38-31-40(20-19-34(38)9-1)36-23-27-43(28-24-36)51(44-29-30-48-47-16-5-6-18-49(47)52-50(48)33-44)42-25-21-35(22-26-42)39-13-7-14-41(32-39)46-17-8-12-37-10-3-4-15-45(37)46;1-2-11-38-32-41(20-19-34(38)9-1)40-14-7-13-39(31-40)35-21-25-42(26-22-35)51(44-29-30-48-47-16-5-6-18-49(47)52-50(48)33-44)43-27-23-37(24-28-43)46-17-8-12-36-10-3-4-15-45(36)46/h1-34H;3*1-33H
InChIKeyRZHCSEKSJIGVLH-UHFFFAOYSA-N
MW2702.50 g/mol
LogP58.39
Rot. Bonds24

About N,N-bis(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-1-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine

N,N-bis(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-1-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine (PubChem CID 160770802) has the molecular formula C200H133N5S3 and a molecular weight of 2702.50 g/mol. Its IUPAC name is N,N-bis(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-1-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine.

Molecular Properties

Compound NameN,N-bis(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-1-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine
PubChem CID160770802
Molecular FormulaC200H133N5S3
Molecular Weight2702.50 g/mol
Exact Mass2699.97
IUPAC NameN,N-bis(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-1-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine
SMILESc1cc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3ccc4c(c3)sc3ccccc34)cc2)cc(-c2ccc3ccccc3c2)c1.c1cc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3ccc4c(c3)sc3ccccc34)cc2)cc(-c2cccc3ccccc23)c1.c1cc(-c2ccc(N(c3ccc(-c4cccc5ccccc45)cc3)c3ccc4c(c3)sc3ccccc34)cc2)cc(-c2ccc3ccccc3c2)c1.c1ccc(-n2c3ccccc3c3c(N(c4ccc(-c5cccc6ccccc56)cc4)c4ccc(-c5cccc6ccccc56)cc4)cccc32)cc1
InChIInChI=1S/C50H34N2.3C50H33NS/c1-2-17-39(18-3-1)52-47-24-9-8-21-46(47)50-48(25-12-26-49(50)52)51(40-31-27-37(28-32-40)44-22-10-15-35-13-4-6-19-42(35)44)41-33-29-38(30-34-41)45-23-11-16-36-14-5-7-20-43(36)45;1-3-10-38-31-42(18-16-34(38)8-1)37-22-26-45(27-23-37)51(46-28-29-48-47-14-5-6-15-49(47)52-50(48)33-46)44-24-20-36(21-25-44)40-12-7-13-41(30-40)43-19-17-35-9-2-4-11-39(35)32-43;1-2-11-38-31-40(20-19-34(38)9-1)36-23-27-43(28-24-36)51(44-29-30-48-47-16-5-6-18-49(47)52-50(48)33-44)42-25-21-35(22-26-42)39-13-7-14-41(32-39)46-17-8-12-37-10-3-4-15-45(37)46;1-2-11-38-32-41(20-19-34(38)9-1)40-14-7-13-39(31-40)35-21-25-42(26-22-35)51(44-29-30-48-47-16-5-6-18-49(47)52-50(48)33-44)43-27-23-37(24-28-43)46-17-8-12-36-10-3-4-15-45(36)46/h1-34H;3*1-33H
InChIKeyRZHCSEKSJIGVLH-UHFFFAOYSA-N
XLogP58.39
TPSA17.89 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds24
Heavy Atoms208
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002702.50
LogP ≤ 558.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze N,N-bis(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-1-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine with MolForge

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Related Compounds

N-dibenzothiophen-3-yl-9-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]carbazol-4-amine
CID 177077852
N-[3-[2-[3-[dibenzofuran-2-yl(naphthalen-2-yl)amino]phenyl]phenyl]phenyl]-N-naphthalen-2-yldibenzofuran-2-amine;N-[4-[3-[4-(N-dibenzothiophen-2-ylanilino)phenyl]phenyl]phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine;N-[3-[3-[3-(N-naphthalen-1-ylanilino)phenyl]phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[3-[4-[3-(N-naphthalen-1-ylanilino)phenyl]phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[2-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 165072526
N-[4-(3-naphthalen-1-ylphenyl)phenyl]-N-(5-naphthalen-2-yl-2-phenylphenyl)dibenzothiophen-3-amine
CID 167235827
4-(3-carbazol-9-ylphenyl)-N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-1-ylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-N-[4-(3-carbazol-9-ylphenyl)phenyl]-4-phenylaniline;4-(3-carbazol-9-ylphenyl)-N-(4-dibenzothiophen-2-ylphenyl)-N-(4-naphthalen-2-ylphenyl)aniline
CID 159549899
3-([1]benzothiolo[2,3-b]carbazol-7-yl)-N-(4-naphthalen-2-ylphenyl)-N-phenylaniline;N-[4-([1]benzothiolo[2,3-b]carbazol-7-yl)phenyl]-3-naphthalen-2-yl-N-phenylaniline;N-[4-([1]benzothiolo[2,3-b]carbazol-7-yl)phenyl]-4-naphthalen-1-yl-N-phenylaniline
CID 158502718
5-naphthalen-2-yl-3-N-(9-phenylcarbazol-4-yl)-1-N,1-N,3-N-tris(4-phenylphenyl)benzene-1,3-diamine;5-naphthalen-2-yl-3-N-(2-phenylphenyl)-1-N,1-N,3-N-tris(4-phenylphenyl)benzene-1,3-diamine;5-naphthalen-2-yl-1-N,1-N,3-N-tris(4-phenylphenyl)-3-N-[4-(3-phenylphenyl)phenyl]benzene-1,3-diamine
CID 163659291
N-[3-[3-(9-naphthalen-1-ylcarbazol-2-yl)phenyl]phenyl]-N-phenyldibenzothiophen-3-amine;N-[3-[3-(9-naphthalen-2-ylcarbazol-2-yl)phenyl]phenyl]-N-phenyldibenzothiophen-3-amine;N-[3-[3-(9-naphthalen-2-ylcarbazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine;N-naphthalen-1-yl-N-[3-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]dibenzothiophen-3-amine
CID 158774946
N-naphthalen-1-yl-N-[3-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]dibenzothiophen-3-amine
CID 129085119
3-(7,9-diphenylcarbazol-4-yl)-N-(4-naphthalen-1-ylphenyl)-N-(4-naphthalen-2-ylphenyl)aniline
CID 166659601
N-[4-(3-naphthalen-2-ylphenyl)phenyl]-9-phenyl-N-(4-phenyldibenzothiophen-1-yl)carbazol-4-amine
CID 168847825
N,N-bis(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-3-amine;N,N-bis(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-4-amine;9-naphthalen-1-yl-N,N-bis(4-naphthalen-1-ylphenyl)carbazol-4-amine;N-(4-naphthalen-1-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-amine
CID 157362791
1-N-[4-[4-[3-[4-[N-dibenzothiophen-3-yl-3-naphthalen-2-yl-5-(4-phenyl-N-(4-phenylphenyl)anilino)anilino]phenyl]phenyl]phenyl]phenyl]-5-naphthalen-2-yl-3-N-(9-phenylcarbazol-3-yl)-1-N,3-N-bis(4-phenylphenyl)benzene-1,3-diamine
CID 146664119

Frequently Asked Questions

What is the IUPAC name of N,N-bis(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-1-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine?
The IUPAC name of N,N-bis(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-1-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine (CID 160770802) is N,N-bis(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-1-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine.
What is the SMILES notation for N,N-bis(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-1-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine?
The canonical SMILES for N,N-bis(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-1-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine is c1cc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3ccc4c(c3)sc3ccccc34)cc2)cc(-c2ccc3ccccc3c2)c1.c1cc(-c2ccc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3ccc4c(c3)sc3ccccc34)cc2)cc(-c2cccc3ccccc23)c1.c1cc(-c2ccc(N(c3ccc(-c4cccc5ccccc45)cc3)c3ccc4c(c3)sc3ccccc34)cc2)cc(-c2ccc3ccccc3c2)c1.c1ccc(-n2c3ccccc3c3c(N(c4ccc(-c5cccc6ccccc56)cc4)c4ccc(-c5cccc6ccccc56)cc4)cccc32)cc1.
What is the InChIKey of N,N-bis(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-1-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine?
The InChIKey is RZHCSEKSJIGVLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H34N2.3C50H33NS/c1-2-17-39(18-3-1)52-47-24-9-8-21-46(47)50-48(25-12-26-49(50)52)51(40-31-27-37(28-32-40)44-22-10-15-35-13-4-6-19-42(35)44)41-33-29-38(30-34-41)45-23-11-16-36-14-5-7-20-43(36)45;1-3-10-38-31-42(18-16-34(38)8-1)37-22-26-45(27-23-37)51(46-28-29-48-47-14-5-6-15-49(47)52-50(48)33-46)44-24-20-36(21-25-44)40-12-7-13-41(30-40)43-19-17-35-9-2-4-11-39(35)32-43;1-2-11-38-31-40(20-19-34(38)9-1)36-23-27-43(28-24-36)51(44-29-30-48-47-16-5-6-18-49(47)52-50(48)33-44)42-25-21-35(22-26-42)39-13-7-14-41(32-39)46-17-8-12-37-10-3-4-15-45(37)46;1-2-11-38-32-41(20-19-34(38)9-1)40-14-7-13-39(31-40)35-21-25-42(26-22-35)51(44-29-30-48-47-16-5-6-18-49(47)52-50(48)33-44)43-27-23-37(24-28-43)46-17-8-12-36-10-3-4-15-45(36)46/h1-34H;3*1-33H.
What are the key properties of N,N-bis(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-1-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine?
N,N-bis(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-1-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine has a molecular weight of 2702.50 g/mol, XLogP of 58.39, 24 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-1-ylphenyl)phenyl]dibenzothiophen-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-3-amine is sourced from PubChem (CID 160770802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).