4-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-N-phenylaniline;N-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-4-(4-phenylphenyl)aniline;N,N-bis[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]naphthalen-2-amine

C148H99N3S6 — CID 165048376

IUPAC4-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-N-phenylaniline;N-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-4-(4-phenylphenyl)aniline;N,N-bis[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]naphthalen-2-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc(-c6cc7ccccc7s6)cc5)cc4)c4ccc(-c5cc6ccccc6s5)cc4)cc3)cc2)cc1.c1ccc(N(c2ccc(-c3ccc(-c4cc5ccccc5s4)cc3)cc2)c2ccc(-c3ccc(-c4cc5ccccc5s4)cc3)cc2)cc1.c1ccc2cc(N(c3ccc(-c4ccc(-c5cc6ccccc6s5)cc4)cc3)c3ccc(-c4ccc(-c5cc6ccccc6s5)cc4)cc3)ccc2c1
InChIInChI=1S/C52H35NS2.C50H33NS2.C46H31NS2/c1-2-8-36(9-3-1)37-14-16-38(17-15-37)40-22-28-46(29-23-40)53(48-32-26-43(27-33-48)52-35-45-11-5-7-13-50(45)55-52)47-30-24-41(25-31-47)39-18-20-42(21-19-39)51-34-44-10-4-6-12-49(44)54-51;1-2-8-41-31-46(30-25-34(41)7-1)51(44-26-21-37(22-27-44)35-13-17-39(18-14-35)49-32-42-9-3-5-11-47(42)52-49)45-28-23-38(24-29-45)36-15-19-40(20-16-36)50-33-43-10-4-6-12-48(43)53-50;1-2-10-40(11-3-1)47(41-26-22-34(23-27-41)32-14-18-36(19-15-32)45-30-38-8-4-6-12-43(38)48-45)42-28-24-35(25-29-42)33-16-20-37(21-17-33)46-31-39-9-5-7-13-44(39)49-46/h1-35H;1-33H;1-31H
InChIKeyPGNQTESEDDRASS-UHFFFAOYSA-N
MW2111.84 g/mol
LogP45.58
Rot. Bonds22

About 4-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-N-phenylaniline;N-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-4-(4-phenylphenyl)aniline;N,N-bis[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]naphthalen-2-amine

4-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-N-phenylaniline;N-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-4-(4-phenylphenyl)aniline;N,N-bis[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]naphthalen-2-amine (PubChem CID 165048376) has the molecular formula C148H99N3S6 and a molecular weight of 2111.84 g/mol. Its IUPAC name is 4-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-N-phenylaniline;N-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-4-(4-phenylphenyl)aniline;N,N-bis[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]naphthalen-2-amine.

Molecular Properties

Compound Name4-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-N-phenylaniline;N-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-4-(4-phenylphenyl)aniline;N,N-bis[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]naphthalen-2-amine
PubChem CID165048376
Molecular FormulaC148H99N3S6
Molecular Weight2111.84 g/mol
Exact Mass2109.62
IUPAC Name4-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-N-phenylaniline;N-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-4-(4-phenylphenyl)aniline;N,N-bis[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]naphthalen-2-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc(-c6cc7ccccc7s6)cc5)cc4)c4ccc(-c5cc6ccccc6s5)cc4)cc3)cc2)cc1.c1ccc(N(c2ccc(-c3ccc(-c4cc5ccccc5s4)cc3)cc2)c2ccc(-c3ccc(-c4cc5ccccc5s4)cc3)cc2)cc1.c1ccc2cc(N(c3ccc(-c4ccc(-c5cc6ccccc6s5)cc4)cc3)c3ccc(-c4ccc(-c5cc6ccccc6s5)cc4)cc3)ccc2c1
InChIInChI=1S/C52H35NS2.C50H33NS2.C46H31NS2/c1-2-8-36(9-3-1)37-14-16-38(17-15-37)40-22-28-46(29-23-40)53(48-32-26-43(27-33-48)52-35-45-11-5-7-13-50(45)55-52)47-30-24-41(25-31-47)39-18-20-42(21-19-39)51-34-44-10-4-6-12-49(44)54-51;1-2-8-41-31-46(30-25-34(41)7-1)51(44-26-21-37(22-27-44)35-13-17-39(18-14-35)49-32-42-9-3-5-11-47(42)52-49)45-28-23-38(24-29-45)36-15-19-40(20-16-36)50-33-43-10-4-6-12-48(43)53-50;1-2-10-40(11-3-1)47(41-26-22-34(23-27-41)32-14-18-36(19-15-32)45-30-38-8-4-6-12-43(38)48-45)42-28-24-35(25-29-42)33-16-20-37(21-17-33)46-31-39-9-5-7-13-44(39)49-46/h1-35H;1-33H;1-31H
InChIKeyPGNQTESEDDRASS-UHFFFAOYSA-N
XLogP45.58
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds22
Heavy Atoms157
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002111.84
LogP ≤ 545.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 4-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-N-phenylaniline;N-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-4-(4-phenylphenyl)aniline;N,N-bis[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]naphthalen-2-amine with MolForge

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Related Compounds

N-[4-(1-benzothiophen-2-yl)phenyl]-4-[4-[4-(N-[4-(1-benzothiophen-2-yl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline
CID 59720610
N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 164744811
4-(1-benzothiophen-2-yl)-N-[4-(1-benzothiophen-2-yl)phenyl]-N-phenylaniline
CID 58636103
N-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(N-[4-(1-benzothiophen-2-yl)phenyl]-4-methylanilino)phenyl]phenyl]-4-methylaniline;N-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(N-[4-(1-benzothiophen-2-yl)phenyl]-4-phenylanilino)phenyl]phenyl]-4-phenylaniline;4-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]anilino)phenyl]phenyl]-N-phenylaniline
CID 158392817
4-benzo[f][1]benzothiol-2-yl-N,N-bis(4-benzo[f][1]benzothiol-2-ylphenyl)aniline;N-[4-(4-benzo[f][1]benzothiol-2-ylphenyl)phenyl]-N-(4-naphthalen-2-ylphenyl)-4-phenylaniline;N-[4-(4-benzo[f][1]benzothiol-2-ylphenyl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N,N-bis(4-benzo[f][1]benzothiol-2-ylphenyl)-4-phenylaniline
CID 165055110
N-[4-[4-[3-(N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 121327966
N-[4-[4-[4-[4-(N-naphthalen-2-ylanilino)phenyl]phenyl]phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 58905935
N,N-bis[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]naphthalen-2-amine;N,N-diphenyl-4-[4-(N-[4-[4-(N-[4-[4-(N-phenylanilino)phenyl]phenyl]anilino)phenyl]phenyl]anilino)phenyl]aniline
CID 160607838
N-[4-[4-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
CID 59029881
2-N,6-N,6-N-triphenyl-2-N-(4-phenylphenyl)naphthalene-2,6-diamine
CID 166917050
N-[4-[4-(N-[4-(1-benzothiophen-2-yl)phenyl]anilino)phenyl]phenyl]-4-[4-(N-[4-[4-(N-[4-(1-benzothiophen-2-yl)phenyl]anilino)phenyl]phenyl]anilino)phenyl]-N-phenylaniline;4-N-[4-(1-benzothiophen-2-yl)phenyl]-1-N-[4-[4-(N-[4-(N-[4-(1-benzothiophen-2-yl)phenyl]anilino)phenyl]anilino)phenyl]phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;N-[4-(1-benzothiophen-3-yl)phenyl]-4-[4-(N-[4-(1-benzothiophen-3-yl)phenyl]anilino)phenyl]-N-phenylaniline;N-[4-(1-benzothiophen-3-yl)phenyl]-N-[4-[4-(N-[4-(1-benzothiophen-3-yl)phenyl]-4-phenylanilino)phenyl]phenyl]-4-phenylaniline
CID 158887917
4-[4-(N-[4-(1,3-benzothiazol-2-yl)phenyl]anilino)phenyl]-N-[4-(1-benzothiophen-2-yl)phenyl]-N-phenylaniline
CID 176651579

Frequently Asked Questions

What is the IUPAC name of 4-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-N-phenylaniline;N-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-4-(4-phenylphenyl)aniline;N,N-bis[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]naphthalen-2-amine?
The IUPAC name of 4-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-N-phenylaniline;N-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-4-(4-phenylphenyl)aniline;N,N-bis[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]naphthalen-2-amine (CID 165048376) is 4-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-N-phenylaniline;N-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-4-(4-phenylphenyl)aniline;N,N-bis[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]naphthalen-2-amine.
What is the SMILES notation for 4-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-N-phenylaniline;N-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-4-(4-phenylphenyl)aniline;N,N-bis[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]naphthalen-2-amine?
The canonical SMILES for 4-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-N-phenylaniline;N-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-4-(4-phenylphenyl)aniline;N,N-bis[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]naphthalen-2-amine is c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc(-c6cc7ccccc7s6)cc5)cc4)c4ccc(-c5cc6ccccc6s5)cc4)cc3)cc2)cc1.c1ccc(N(c2ccc(-c3ccc(-c4cc5ccccc5s4)cc3)cc2)c2ccc(-c3ccc(-c4cc5ccccc5s4)cc3)cc2)cc1.c1ccc2cc(N(c3ccc(-c4ccc(-c5cc6ccccc6s5)cc4)cc3)c3ccc(-c4ccc(-c5cc6ccccc6s5)cc4)cc3)ccc2c1.
What is the InChIKey of 4-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-N-phenylaniline;N-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-4-(4-phenylphenyl)aniline;N,N-bis[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]naphthalen-2-amine?
The InChIKey is PGNQTESEDDRASS-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H35NS2.C50H33NS2.C46H31NS2/c1-2-8-36(9-3-1)37-14-16-38(17-15-37)40-22-28-46(29-23-40)53(48-32-26-43(27-33-48)52-35-45-11-5-7-13-50(45)55-52)47-30-24-41(25-31-47)39-18-20-42(21-19-39)51-34-44-10-4-6-12-49(44)54-51;1-2-8-41-31-46(30-25-34(41)7-1)51(44-26-21-37(22-27-44)35-13-17-39(18-14-35)49-32-42-9-3-5-11-47(42)52-49)45-28-23-38(24-29-45)36-15-19-40(20-16-36)50-33-43-10-4-6-12-48(43)53-50;1-2-10-40(11-3-1)47(41-26-22-34(23-27-41)32-14-18-36(19-15-32)45-30-38-8-4-6-12-43(38)48-45)42-28-24-35(25-29-42)33-16-20-37(21-17-33)46-31-39-9-5-7-13-44(39)49-46/h1-35H;1-33H;1-31H.
What are the key properties of 4-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-N-phenylaniline;N-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-4-(4-phenylphenyl)aniline;N,N-bis[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]naphthalen-2-amine?
4-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-N-phenylaniline;N-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-4-(4-phenylphenyl)aniline;N,N-bis[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]naphthalen-2-amine has a molecular weight of 2111.84 g/mol, XLogP of 45.58, 22 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-N-phenylaniline;N-[4-(1-benzothiophen-2-yl)phenyl]-N-[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]-4-(4-phenylphenyl)aniline;N,N-bis[4-[4-(1-benzothiophen-2-yl)phenyl]phenyl]naphthalen-2-amine is sourced from PubChem (CID 165048376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).