N-dibenzothiophen-2-yl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-(4-triphenylen-2-ylphenyl)dibenzofuran-4-amine

C174H110N4O4S4 — CID 163977940

IUPACN-dibenzothiophen-2-yl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-(4-triphenylen-2-ylphenyl)dibenzofuran-4-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc5sc6ccccc6c5c4)c4cccc5c4oc4ccccc45)cc3)cc2)cc1.c1ccc(-c2ccc(-c3cccc(N(c4ccc5sc6ccccc6c5c4)c4cccc5c4oc4ccccc45)c3)cc2)cc1.c1ccc(-c2ccc(-c3ccccc3N(c3ccc4sc5ccccc5c4c3)c3cccc4c3oc3ccccc34)cc2)cc1.c1ccc2c(c1)oc1c(N(c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc3)c3ccc4sc5ccccc5c4c3)cccc12
InChIInChI=1S/C48H29NOS.3C42H27NOS/c1-2-12-36-34(10-1)35-11-3-4-13-37(35)42-28-31(22-26-38(36)42)30-20-23-32(24-21-30)49(33-25-27-47-43(29-33)40-15-6-8-19-46(40)51-47)44-17-9-16-41-39-14-5-7-18-45(39)50-48(41)44;1-2-11-28(12-3-1)29-21-23-30(24-22-29)32-13-4-7-17-37(32)43(31-25-26-41-36(27-31)34-15-6-9-20-40(34)45-41)38-18-10-16-35-33-14-5-8-19-39(33)44-42(35)38;1-2-10-28(11-3-1)29-20-22-30(23-21-29)31-12-8-13-32(26-31)43(33-24-25-41-37(27-33)35-15-5-7-19-40(35)45-41)38-17-9-16-36-34-14-4-6-18-39(34)44-42(36)38;1-2-9-28(10-3-1)29-17-19-30(20-18-29)31-21-23-32(24-22-31)43(33-25-26-41-37(27-33)35-12-5-7-16-40(35)45-41)38-14-8-13-36-34-11-4-6-15-39(34)44-42(36)38/h1-29H;3*1-27H
InChIKeySVUVAZYXURUSOU-UHFFFAOYSA-N
MW2449.09 g/mol
LogP52.82
Rot. Bonds19

About N-dibenzothiophen-2-yl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-(4-triphenylen-2-ylphenyl)dibenzofuran-4-amine

N-dibenzothiophen-2-yl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-(4-triphenylen-2-ylphenyl)dibenzofuran-4-amine (PubChem CID 163977940) has the molecular formula C174H110N4O4S4 and a molecular weight of 2449.09 g/mol. Its IUPAC name is N-dibenzothiophen-2-yl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-(4-triphenylen-2-ylphenyl)dibenzofuran-4-amine.

Molecular Properties

Compound NameN-dibenzothiophen-2-yl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-(4-triphenylen-2-ylphenyl)dibenzofuran-4-amine
PubChem CID163977940
Molecular FormulaC174H110N4O4S4
Molecular Weight2449.09 g/mol
Exact Mass2446.74
IUPAC NameN-dibenzothiophen-2-yl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-(4-triphenylen-2-ylphenyl)dibenzofuran-4-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc5sc6ccccc6c5c4)c4cccc5c4oc4ccccc45)cc3)cc2)cc1.c1ccc(-c2ccc(-c3cccc(N(c4ccc5sc6ccccc6c5c4)c4cccc5c4oc4ccccc45)c3)cc2)cc1.c1ccc(-c2ccc(-c3ccccc3N(c3ccc4sc5ccccc5c4c3)c3cccc4c3oc3ccccc34)cc2)cc1.c1ccc2c(c1)oc1c(N(c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc3)c3ccc4sc5ccccc5c4c3)cccc12
InChIInChI=1S/C48H29NOS.3C42H27NOS/c1-2-12-36-34(10-1)35-11-3-4-13-37(35)42-28-31(22-26-38(36)42)30-20-23-32(24-21-30)49(33-25-27-47-43(29-33)40-15-6-8-19-46(40)51-47)44-17-9-16-41-39-14-5-7-18-45(39)50-48(41)44;1-2-11-28(12-3-1)29-21-23-30(24-22-29)32-13-4-7-17-37(32)43(31-25-26-41-36(27-31)34-15-6-9-20-40(34)45-41)38-18-10-16-35-33-14-5-8-19-39(33)44-42(35)38;1-2-10-28(11-3-1)29-20-22-30(23-21-29)31-12-8-13-32(26-31)43(33-24-25-41-37(27-33)35-15-5-7-19-40(35)45-41)38-17-9-16-36-34-14-4-6-18-39(34)44-42(36)38;1-2-9-28(10-3-1)29-17-19-30(20-18-29)31-21-23-32(24-22-31)43(33-25-26-41-37(27-33)35-12-5-7-16-40(35)45-41)38-14-8-13-36-34-11-4-6-15-39(34)44-42(36)38/h1-29H;3*1-27H
InChIKeySVUVAZYXURUSOU-UHFFFAOYSA-N
XLogP52.82
TPSA65.52 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds19
Heavy Atoms186
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002449.09
LogP ≤ 552.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze N-dibenzothiophen-2-yl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-(4-triphenylen-2-ylphenyl)dibenzofuran-4-amine with MolForge

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Related Compounds

N-(2-dibenzothiophen-2-ylphenyl)-N-[3-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-4-amine
CID 167325008
N-(4-dibenzothiophen-2-ylphenyl)-N-(3-naphthalen-1-ylphenyl)dibenzofuran-4-amine
CID 167324430
N-dibenzothiophen-3-yl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-amine
CID 163957586
N-(3-dibenzothiophen-2-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 155186779
N-(3-dibenzothiophen-2-ylphenyl)-N-(6-phenyldibenzothiophen-4-yl)dibenzofuran-4-amine
CID 167397233
5-N-dibenzofuran-3-yl-18-N-dibenzofuran-4-yl-5-N,18-N-bis(2-phenylphenyl)-21-thiapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaene-5,18-diamine;5-N-dibenzofuran-3-yl-18-N-dibenzofuran-4-yl-5-N-phenyl-18-N-(2-phenylphenyl)-21-thiapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaene-5,18-diamine;18-N-dibenzofuran-4-yl-5-N-dibenzothiophen-2-yl-5-N,18-N-bis(2-phenylphenyl)-21-thiapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaene-5,18-diamine
CID 158660183
N,N-bis(4-dibenzofuran-4-ylphenyl)-3-dibenzothiophen-2-ylaniline
CID 118428236
N-(4-dibenzofuran-4-ylphenyl)-2-dibenzothiophen-2-yl-N-(3-naphthalen-1-ylphenyl)aniline
CID 167326462
N,N-bis[4-(4-dibenzothiophen-2-ylphenyl)phenyl]triphenylen-2-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]triphenylen-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-dibenzofuran-4-ylphenyl)phenyl]triphenylen-2-amine
CID 157196864
N-dibenzothiophen-2-yl-N-phenyl-8-[4-[2-(N-phenylanilino)phenyl]phenyl]dibenzofuran-3-amine
CID 155172831
3-N-dibenzothiophen-3-yl-3-N,6-N-diphenyl-6-N-(2-phenylphenyl)dibenzofuran-3,6-diamine
CID 146574174
N-[4-[3-[4-(N-dibenzothiophen-4-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzofuran-4-amine;N-[4-[3-[4-(N-dibenzothiophen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenyldibenzothiophen-2-amine;N-[4-[3-[4-(N-(4-phenoxyphenyl)anilino)phenyl]phenyl]phenyl]-N,4-diphenylaniline;N-phenyl-3-[3-[4-(N-phenylanilino)phenyl]phenyl]-N-(4-phenylphenyl)aniline;N-phenyl-N-(4-phenylphenyl)-2-[3-[2-(N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline;N-phenyl-N-(4-phenylphenyl)-2-[3-[4-(N-(4-phenylphenyl)anilino)phenyl]phenyl]aniline
CID 161129791

Frequently Asked Questions

What is the IUPAC name of N-dibenzothiophen-2-yl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-(4-triphenylen-2-ylphenyl)dibenzofuran-4-amine?
The IUPAC name of N-dibenzothiophen-2-yl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-(4-triphenylen-2-ylphenyl)dibenzofuran-4-amine (CID 163977940) is N-dibenzothiophen-2-yl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-(4-triphenylen-2-ylphenyl)dibenzofuran-4-amine.
What is the SMILES notation for N-dibenzothiophen-2-yl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-(4-triphenylen-2-ylphenyl)dibenzofuran-4-amine?
The canonical SMILES for N-dibenzothiophen-2-yl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-(4-triphenylen-2-ylphenyl)dibenzofuran-4-amine is c1ccc(-c2ccc(-c3ccc(N(c4ccc5sc6ccccc6c5c4)c4cccc5c4oc4ccccc45)cc3)cc2)cc1.c1ccc(-c2ccc(-c3cccc(N(c4ccc5sc6ccccc6c5c4)c4cccc5c4oc4ccccc45)c3)cc2)cc1.c1ccc(-c2ccc(-c3ccccc3N(c3ccc4sc5ccccc5c4c3)c3cccc4c3oc3ccccc34)cc2)cc1.c1ccc2c(c1)oc1c(N(c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc3)c3ccc4sc5ccccc5c4c3)cccc12.
What is the InChIKey of N-dibenzothiophen-2-yl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-(4-triphenylen-2-ylphenyl)dibenzofuran-4-amine?
The InChIKey is SVUVAZYXURUSOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H29NOS.3C42H27NOS/c1-2-12-36-34(10-1)35-11-3-4-13-37(35)42-28-31(22-26-38(36)42)30-20-23-32(24-21-30)49(33-25-27-47-43(29-33)40-15-6-8-19-46(40)51-47)44-17-9-16-41-39-14-5-7-18-45(39)50-48(41)44;1-2-11-28(12-3-1)29-21-23-30(24-22-29)32-13-4-7-17-37(32)43(31-25-26-41-36(27-31)34-15-6-9-20-40(34)45-41)38-18-10-16-35-33-14-5-8-19-39(33)44-42(35)38;1-2-10-28(11-3-1)29-20-22-30(23-21-29)31-12-8-13-32(26-31)43(33-24-25-41-37(27-33)35-15-5-7-19-40(35)45-41)38-17-9-16-36-34-14-4-6-18-39(34)44-42(36)38;1-2-9-28(10-3-1)29-17-19-30(20-18-29)31-21-23-32(24-22-31)43(33-25-26-41-37(27-33)35-12-5-7-16-40(35)45-41)38-14-8-13-36-34-11-4-6-15-39(34)44-42(36)38/h1-29H;3*1-27H.
What are the key properties of N-dibenzothiophen-2-yl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-(4-triphenylen-2-ylphenyl)dibenzofuran-4-amine?
N-dibenzothiophen-2-yl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-(4-triphenylen-2-ylphenyl)dibenzofuran-4-amine has a molecular weight of 2449.09 g/mol, XLogP of 52.82, 19 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzothiophen-2-yl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-dibenzothiophen-2-yl-N-(4-triphenylen-2-ylphenyl)dibenzofuran-4-amine is sourced from PubChem (CID 163977940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).