N,1-diphenyldibenzothiophen-3-amine

C24H17NS — CID 170046068

IUPACN,1-diphenyldibenzothiophen-3-amine
SMILESc1ccc(Nc2cc(-c3ccccc3)c3c(c2)sc2ccccc23)cc1
InChIInChI=1S/C24H17NS/c1-3-9-17(10-4-1)21-15-19(25-18-11-5-2-6-12-18)16-23-24(21)20-13-7-8-14-22(20)26-23/h1-16,25H
InChIKeyLZGCAVXDTOMUCW-UHFFFAOYSA-N
MW351.47 g/mol
LogP7.47
Rot. Bonds3

About N,1-diphenyldibenzothiophen-3-amine

N,1-diphenyldibenzothiophen-3-amine (PubChem CID 170046068) has the molecular formula C24H17NS and a molecular weight of 351.47 g/mol. Its IUPAC name is N,1-diphenyldibenzothiophen-3-amine.

Molecular Properties

Compound NameN,1-diphenyldibenzothiophen-3-amine
PubChem CID170046068
Molecular FormulaC24H17NS
Molecular Weight351.47 g/mol
Exact Mass351.11
IUPAC NameN,1-diphenyldibenzothiophen-3-amine
SMILESc1ccc(Nc2cc(-c3ccccc3)c3c(c2)sc2ccccc23)cc1
InChIInChI=1S/C24H17NS/c1-3-9-17(10-4-1)21-15-19(25-18-11-5-2-6-12-18)16-23-24(21)20-13-7-8-14-22(20)26-23/h1-16,25H
InChIKeyLZGCAVXDTOMUCW-UHFFFAOYSA-N
XLogP7.47
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.47
LogP ≤ 57.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N,1-diphenyldibenzothiophen-3-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

4-dibenzothiophen-1-yl-N-phenylaniline
CID 134240778
1-phenoxy-N-phenyldibenzothiophen-3-amine
CID 164801821
N,9-diphenyldibenzothiophen-2-amine
CID 139422574
3-N-dibenzothiophen-2-yl-1-N,5-diphenylbenzene-1,3-diamine
CID 139380088
N-(3-dibenzothiophen-1-ylphenyl)naphthalen-2-amine
CID 169073524
1-phenyldibenzothiophene;hydrobromide
CID 174679709
N-phenyldibenzothiophen-1-amine
CID 126538366
2-phenyl-4-[4-(1-phenyldibenzothiophen-3-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazine
CID 168850299
3-dibenzothiophen-1-yl-N-phenylaniline;3-dibenzothiophen-2-yl-N-phenylaniline;4-dibenzothiophen-4-yl-N-phenylaniline;3-(3-dibenzothiophen-1-ylphenyl)-N-phenylaniline
CID 167592386
N-(4-naphthalen-1-ylphenyl)dibenzothiophen-2-amine;N-(3-phenylphenyl)dibenzothiophen-2-amine;N-(4-phenylphenyl)dibenzothiophen-2-amine;N-(4-phenylphenyl)dibenzothiophen-3-amine
CID 164973575
3-dibenzothiophen-1-yl-1-[4-(3,4-diphenylphenyl)phenyl]dibenzothiophene
CID 165093475
1,1'-biphenyl;4-naphthalen-2-yl-N-[4-(2-phenyldibenzothiophen-3-yl)phenyl]aniline
CID 142405945

Frequently Asked Questions

What is the IUPAC name of N,1-diphenyldibenzothiophen-3-amine?
The IUPAC name of N,1-diphenyldibenzothiophen-3-amine (CID 170046068) is N,1-diphenyldibenzothiophen-3-amine.
What is the SMILES notation for N,1-diphenyldibenzothiophen-3-amine?
The canonical SMILES for N,1-diphenyldibenzothiophen-3-amine is c1ccc(Nc2cc(-c3ccccc3)c3c(c2)sc2ccccc23)cc1.
What is the InChIKey of N,1-diphenyldibenzothiophen-3-amine?
The InChIKey is LZGCAVXDTOMUCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17NS/c1-3-9-17(10-4-1)21-15-19(25-18-11-5-2-6-12-18)16-23-24(21)20-13-7-8-14-22(20)26-23/h1-16,25H.
What are the key properties of N,1-diphenyldibenzothiophen-3-amine?
N,1-diphenyldibenzothiophen-3-amine has a molecular weight of 351.47 g/mol, XLogP of 7.47, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-diphenyldibenzothiophen-3-amine is sourced from PubChem (CID 170046068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).