10-dibenzothiophen-3-yl-N-(3-phenylphenyl)-N-(4-phenylphenyl)phenoxazin-3-amine

C48H32N2OS — CID 164811783

IUPAC10-dibenzothiophen-3-yl-N-(3-phenylphenyl)-N-(4-phenylphenyl)phenoxazin-3-amine
SMILESc1ccc(-c2ccc(N(c3cccc(-c4ccccc4)c3)c3ccc4c(c3)Oc3ccccc3N4c3ccc4c(c3)sc3ccccc34)cc2)cc1
InChIInChI=1S/C48H32N2OS/c1-3-12-33(13-4-1)35-22-24-37(25-23-35)49(38-17-11-16-36(30-38)34-14-5-2-6-15-34)39-27-29-44-46(31-39)51-45-20-9-8-19-43(45)50(44)40-26-28-42-41-18-7-10-21-47(41)52-48(42)32-40/h1-32H
InChIKeyNOYCHLCTEBBKNG-UHFFFAOYSA-N
MW684.86 g/mol
LogP14.43
Rot. Bonds6

About 10-dibenzothiophen-3-yl-N-(3-phenylphenyl)-N-(4-phenylphenyl)phenoxazin-3-amine

10-dibenzothiophen-3-yl-N-(3-phenylphenyl)-N-(4-phenylphenyl)phenoxazin-3-amine (PubChem CID 164811783) has the molecular formula C48H32N2OS and a molecular weight of 684.86 g/mol. Its IUPAC name is 10-dibenzothiophen-3-yl-N-(3-phenylphenyl)-N-(4-phenylphenyl)phenoxazin-3-amine.

Molecular Properties

Compound Name10-dibenzothiophen-3-yl-N-(3-phenylphenyl)-N-(4-phenylphenyl)phenoxazin-3-amine
PubChem CID164811783
Molecular FormulaC48H32N2OS
Molecular Weight684.86 g/mol
Exact Mass684.22
IUPAC Name10-dibenzothiophen-3-yl-N-(3-phenylphenyl)-N-(4-phenylphenyl)phenoxazin-3-amine
SMILESc1ccc(-c2ccc(N(c3cccc(-c4ccccc4)c3)c3ccc4c(c3)Oc3ccccc3N4c3ccc4c(c3)sc3ccccc34)cc2)cc1
InChIInChI=1S/C48H32N2OS/c1-3-12-33(13-4-1)35-22-24-37(25-23-35)49(38-17-11-16-36(30-38)34-14-5-2-6-15-34)39-27-29-44-46(31-39)51-45-20-9-8-19-43(45)50(44)40-26-28-42-41-18-7-10-21-47(41)52-48(42)32-40/h1-32H
InChIKeyNOYCHLCTEBBKNG-UHFFFAOYSA-N
XLogP14.43
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500684.86
LogP ≤ 514.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-dibenzofuran-2-yl-10-dibenzothiophen-3-yl-N-(4-phenylphenyl)phenoxazin-3-amine
CID 163553739
10-dibenzothiophen-3-yl-N-phenyl-N-(9-phenylcarbazol-2-yl)phenoxazin-3-amine
CID 164811785
N-(4-carbazol-9-ylphenyl)-10-dibenzofuran-3-yl-N-(3-phenylphenyl)phenoxazin-3-amine;N-dibenzofuran-2-yl-10-dibenzofuran-3-yl-N-(3-phenylphenyl)phenoxazin-3-amine;10-dibenzofuran-3-yl-N-dibenzothiophen-2-yl-N-(3-phenylphenyl)phenoxazin-3-amine
CID 165094290
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
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
7-N-dibenzothiophen-3-yl-2-N,2-N-diphenyl-7-N-[4-[3-(N-phenylanilino)phenyl]phenyl]dibenzothiophene-2,7-diamine
CID 131979873
N,N-bis[4-(3-phenoxazin-10-ylphenyl)phenyl]-4-phenylaniline
CID 122425451
N-[4-(3-phenoxazin-10-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 122425440
N-dibenzothiophen-3-yl-N-(4-phenylphenyl)dibenzothiophen-3-amine
CID 154031425
2-N,2-N-diphenyl-7-N-[4-[3-(N-phenylanilino)phenyl]phenyl]-7-N-(4-phenylphenyl)dibenzothiophene-2,7-diamine
CID 131979910
N-[4-(3-dibenzothiophen-3-ylphenyl)phenyl]-N,4-diphenylaniline
CID 118186818
3-(8,14-dioxa-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-11-yl)-N,N-bis(4-phenylphenyl)aniline;N-[4-[3-(8,14-dioxa-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-11-yl)phenyl]phenyl]-N,4-diphenylaniline;N-[4-[3-(8,14-dioxa-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-11-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[3-(8,14-dioxa-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15,17,19-nonaen-5-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 157154846

Frequently Asked Questions

What is the IUPAC name of 10-dibenzothiophen-3-yl-N-(3-phenylphenyl)-N-(4-phenylphenyl)phenoxazin-3-amine?
The IUPAC name of 10-dibenzothiophen-3-yl-N-(3-phenylphenyl)-N-(4-phenylphenyl)phenoxazin-3-amine (CID 164811783) is 10-dibenzothiophen-3-yl-N-(3-phenylphenyl)-N-(4-phenylphenyl)phenoxazin-3-amine.
What is the SMILES notation for 10-dibenzothiophen-3-yl-N-(3-phenylphenyl)-N-(4-phenylphenyl)phenoxazin-3-amine?
The canonical SMILES for 10-dibenzothiophen-3-yl-N-(3-phenylphenyl)-N-(4-phenylphenyl)phenoxazin-3-amine is c1ccc(-c2ccc(N(c3cccc(-c4ccccc4)c3)c3ccc4c(c3)Oc3ccccc3N4c3ccc4c(c3)sc3ccccc34)cc2)cc1.
What is the InChIKey of 10-dibenzothiophen-3-yl-N-(3-phenylphenyl)-N-(4-phenylphenyl)phenoxazin-3-amine?
The InChIKey is NOYCHLCTEBBKNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H32N2OS/c1-3-12-33(13-4-1)35-22-24-37(25-23-35)49(38-17-11-16-36(30-38)34-14-5-2-6-15-34)39-27-29-44-46(31-39)51-45-20-9-8-19-43(45)50(44)40-26-28-42-41-18-7-10-21-47(41)52-48(42)32-40/h1-32H.
What are the key properties of 10-dibenzothiophen-3-yl-N-(3-phenylphenyl)-N-(4-phenylphenyl)phenoxazin-3-amine?
10-dibenzothiophen-3-yl-N-(3-phenylphenyl)-N-(4-phenylphenyl)phenoxazin-3-amine has a molecular weight of 684.86 g/mol, XLogP of 14.43, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 10-dibenzothiophen-3-yl-N-(3-phenylphenyl)-N-(4-phenylphenyl)phenoxazin-3-amine is sourced from PubChem (CID 164811783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).