8-(9H-carbazol-1-yl)-N,N-dinaphthalen-2-yldibenzothiophen-2-amine

C44H28N2S — CID 154697158

IUPAC8-(9H-carbazol-1-yl)-N,N-dinaphthalen-2-yldibenzothiophen-2-amine
SMILESc1ccc2cc(N(c3ccc4ccccc4c3)c3ccc4sc5ccc(-c6cccc7c6[nH]c6ccccc67)cc5c4c3)ccc2c1
InChIInChI=1S/C44H28N2S/c1-3-10-30-24-33(19-16-28(30)8-1)46(34-20-17-29-9-2-4-11-31(29)25-34)35-21-23-43-40(27-35)39-26-32(18-22-42(39)47-43)36-13-7-14-38-37-12-5-6-15-41(37)45-44(36)38/h1-27,45H
InChIKeyQWHPQROJANZNFV-UHFFFAOYSA-N
MW616.79 g/mol
LogP13.13
Rot. Bonds4

About 8-(9H-carbazol-1-yl)-N,N-dinaphthalen-2-yldibenzothiophen-2-amine

8-(9H-carbazol-1-yl)-N,N-dinaphthalen-2-yldibenzothiophen-2-amine (PubChem CID 154697158) has the molecular formula C44H28N2S and a molecular weight of 616.79 g/mol. Its IUPAC name is 8-(9H-carbazol-1-yl)-N,N-dinaphthalen-2-yldibenzothiophen-2-amine.

Molecular Properties

Compound Name8-(9H-carbazol-1-yl)-N,N-dinaphthalen-2-yldibenzothiophen-2-amine
PubChem CID154697158
Molecular FormulaC44H28N2S
Molecular Weight616.79 g/mol
Exact Mass616.20
IUPAC Name8-(9H-carbazol-1-yl)-N,N-dinaphthalen-2-yldibenzothiophen-2-amine
SMILESc1ccc2cc(N(c3ccc4ccccc4c3)c3ccc4sc5ccc(-c6cccc7c6[nH]c6ccccc67)cc5c4c3)ccc2c1
InChIInChI=1S/C44H28N2S/c1-3-10-30-24-33(19-16-28(30)8-1)46(34-20-17-29-9-2-4-11-31(29)25-34)35-21-23-43-40(27-35)39-26-32(18-22-42(39)47-43)36-13-7-14-38-37-12-5-6-15-41(37)45-44(36)38/h1-27,45H
InChIKeyQWHPQROJANZNFV-UHFFFAOYSA-N
XLogP13.13
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms47
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500616.79
LogP ≤ 513.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 8-(9H-carbazol-1-yl)-N,N-dinaphthalen-2-yldibenzothiophen-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-naphthalen-2-yl-8-[7-(N-phenylanilino)dibenzothiophen-3-yl]-N-(4-phenylphenyl)-9H-carbazol-3-amine
CID 154697274
8-(9H-carbazol-1-yl)-N-naphthalen-2-yl-N-(4-phenylphenyl)dibenzofuran-2-amine
CID 154697151
1-dibenzothiophen-1-yl-N,N-dinaphthalen-2-yl-9H-carbazol-3-amine
CID 154697134
1-(4-dibenzothiophen-2-ylphenyl)-9H-carbazole
CID 142569531
N-naphthalen-2-yl-N-[6-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]dibenzothiophen-2-amine
CID 174256490
3-(9H-carbazol-1-yl)-N,N-bis[4-(9H-carbazol-1-yl)phenyl]aniline
CID 141212248
N-(4-dibenzothiophen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-2-amine
CID 166565819
N-naphthalen-2-yl-N-[4-(3-phenylphenyl)phenyl]dibenzothiophen-2-amine
CID 118405870
N,N-bis(4-dibenzothiophen-2-ylphenyl)-3-naphthalen-2-ylaniline
CID 163723915
N-(3-dibenzothiophen-4-ylphenyl)-N-(4-naphthalen-2-ylphenyl)dibenzothiophen-2-amine
CID 168767596
8-(4-dibenzothiophen-2-ylphenyl)-7H-benzo[c]carbazole
CID 142567945
1-naphtho[2,1-b][1]benzothiol-9-yl-6-phenyl-9H-carbazole
CID 142570567

Frequently Asked Questions

What is the IUPAC name of 8-(9H-carbazol-1-yl)-N,N-dinaphthalen-2-yldibenzothiophen-2-amine?
The IUPAC name of 8-(9H-carbazol-1-yl)-N,N-dinaphthalen-2-yldibenzothiophen-2-amine (CID 154697158) is 8-(9H-carbazol-1-yl)-N,N-dinaphthalen-2-yldibenzothiophen-2-amine.
What is the SMILES notation for 8-(9H-carbazol-1-yl)-N,N-dinaphthalen-2-yldibenzothiophen-2-amine?
The canonical SMILES for 8-(9H-carbazol-1-yl)-N,N-dinaphthalen-2-yldibenzothiophen-2-amine is c1ccc2cc(N(c3ccc4ccccc4c3)c3ccc4sc5ccc(-c6cccc7c6[nH]c6ccccc67)cc5c4c3)ccc2c1.
What is the InChIKey of 8-(9H-carbazol-1-yl)-N,N-dinaphthalen-2-yldibenzothiophen-2-amine?
The InChIKey is QWHPQROJANZNFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H28N2S/c1-3-10-30-24-33(19-16-28(30)8-1)46(34-20-17-29-9-2-4-11-31(29)25-34)35-21-23-43-40(27-35)39-26-32(18-22-42(39)47-43)36-13-7-14-38-37-12-5-6-15-41(37)45-44(36)38/h1-27,45H.
What are the key properties of 8-(9H-carbazol-1-yl)-N,N-dinaphthalen-2-yldibenzothiophen-2-amine?
8-(9H-carbazol-1-yl)-N,N-dinaphthalen-2-yldibenzothiophen-2-amine has a molecular weight of 616.79 g/mol, XLogP of 13.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(9H-carbazol-1-yl)-N,N-dinaphthalen-2-yldibenzothiophen-2-amine is sourced from PubChem (CID 154697158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).