N-(4-dibenzoselenophen-2-ylphenyl)-N-naphthalen-2-yl-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine

C152H100N6Se3 — CID 160962142

IUPACN-(4-dibenzoselenophen-2-ylphenyl)-N-naphthalen-2-yl-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc6[se]c7ccccc7c6c5)cc4)c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)cc2)cc1.c1ccc(-n2c3ccccc3c3cc(N(c4ccc(-c5ccc6[se]c7ccccc7c6c5)cc4)c4ccc(-c5cccc6ccccc56)cc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(N(c4ccc(-c5ccc6[se]c7ccccc7c6c5)cc4)c4ccc5ccccc5c4)ccc32)cc1
InChIInChI=1S/C54H36N2Se.C52H34N2Se.C46H30N2Se/c1-3-11-37(12-4-1)38-19-21-39(22-20-38)40-23-28-44(29-24-40)55(45-30-25-41(26-31-45)42-27-34-54-50(35-42)48-16-8-10-18-53(48)57-54)46-32-33-52-49(36-46)47-15-7-9-17-51(47)56(52)43-13-5-2-6-14-43;1-2-13-39(14-3-1)54-49-19-8-6-16-45(49)47-34-42(30-31-50(47)54)53(41-28-23-37(24-29-41)44-18-10-12-36-11-4-5-15-43(36)44)40-26-21-35(22-27-40)38-25-32-52-48(33-38)46-17-7-9-20-51(46)55-52;1-2-12-35(13-3-1)48-43-16-8-6-14-39(43)41-30-38(25-26-44(41)48)47(37-24-20-31-10-4-5-11-33(31)28-37)36-22-18-32(19-23-36)34-21-27-46-42(29-34)40-15-7-9-17-45(40)49-46/h1-36H;1-34H;1-30H
InChIKeySXDJDMPCZPICOL-UHFFFAOYSA-N
MW2247.39 g/mol
LogP41.16
Rot. Bonds18

About N-(4-dibenzoselenophen-2-ylphenyl)-N-naphthalen-2-yl-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine

N-(4-dibenzoselenophen-2-ylphenyl)-N-naphthalen-2-yl-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine (PubChem CID 160962142) has the molecular formula C152H100N6Se3 and a molecular weight of 2247.39 g/mol. Its IUPAC name is N-(4-dibenzoselenophen-2-ylphenyl)-N-naphthalen-2-yl-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine.

Molecular Properties

Compound NameN-(4-dibenzoselenophen-2-ylphenyl)-N-naphthalen-2-yl-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine
PubChem CID160962142
Molecular FormulaC152H100N6Se3
Molecular Weight2247.39 g/mol
Exact Mass2248.55
IUPAC NameN-(4-dibenzoselenophen-2-ylphenyl)-N-naphthalen-2-yl-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc6[se]c7ccccc7c6c5)cc4)c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)cc2)cc1.c1ccc(-n2c3ccccc3c3cc(N(c4ccc(-c5ccc6[se]c7ccccc7c6c5)cc4)c4ccc(-c5cccc6ccccc56)cc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(N(c4ccc(-c5ccc6[se]c7ccccc7c6c5)cc4)c4ccc5ccccc5c4)ccc32)cc1
InChIInChI=1S/C54H36N2Se.C52H34N2Se.C46H30N2Se/c1-3-11-37(12-4-1)38-19-21-39(22-20-38)40-23-28-44(29-24-40)55(45-30-25-41(26-31-45)42-27-34-54-50(35-42)48-16-8-10-18-53(48)57-54)46-32-33-52-49(36-46)47-15-7-9-17-51(47)56(52)43-13-5-2-6-14-43;1-2-13-39(14-3-1)54-49-19-8-6-16-45(49)47-34-42(30-31-50(47)54)53(41-28-23-37(24-29-41)44-18-10-12-36-11-4-5-15-43(36)44)40-26-21-35(22-27-40)38-25-32-52-48(33-38)46-17-7-9-20-51(46)55-52;1-2-12-35(13-3-1)48-43-16-8-6-14-39(43)41-30-38(25-26-44(41)48)47(37-24-20-31-10-4-5-11-33(31)28-37)36-22-18-32(19-23-36)34-21-27-46-42(29-34)40-15-7-9-17-45(40)49-46/h1-36H;1-34H;1-30H
InChIKeySXDJDMPCZPICOL-UHFFFAOYSA-N
XLogP41.16
TPSA24.51 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds18
Heavy Atoms161
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002247.39
LogP ≤ 541.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze N-(4-dibenzoselenophen-2-ylphenyl)-N-naphthalen-2-yl-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-(4-dibenzoselenophen-2-ylphenyl)-N-naphthalen-2-yl-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine?
The IUPAC name of N-(4-dibenzoselenophen-2-ylphenyl)-N-naphthalen-2-yl-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine (CID 160962142) is N-(4-dibenzoselenophen-2-ylphenyl)-N-naphthalen-2-yl-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine.
What is the SMILES notation for N-(4-dibenzoselenophen-2-ylphenyl)-N-naphthalen-2-yl-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine?
The canonical SMILES for N-(4-dibenzoselenophen-2-ylphenyl)-N-naphthalen-2-yl-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine is c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc6[se]c7ccccc7c6c5)cc4)c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)cc2)cc1.c1ccc(-n2c3ccccc3c3cc(N(c4ccc(-c5ccc6[se]c7ccccc7c6c5)cc4)c4ccc(-c5cccc6ccccc56)cc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(N(c4ccc(-c5ccc6[se]c7ccccc7c6c5)cc4)c4ccc5ccccc5c4)ccc32)cc1.
What is the InChIKey of N-(4-dibenzoselenophen-2-ylphenyl)-N-naphthalen-2-yl-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine?
The InChIKey is SXDJDMPCZPICOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H36N2Se.C52H34N2Se.C46H30N2Se/c1-3-11-37(12-4-1)38-19-21-39(22-20-38)40-23-28-44(29-24-40)55(45-30-25-41(26-31-45)42-27-34-54-50(35-42)48-16-8-10-18-53(48)57-54)46-32-33-52-49(36-46)47-15-7-9-17-51(47)56(52)43-13-5-2-6-14-43;1-2-13-39(14-3-1)54-49-19-8-6-16-45(49)47-34-42(30-31-50(47)54)53(41-28-23-37(24-29-41)44-18-10-12-36-11-4-5-15-43(36)44)40-26-21-35(22-27-40)38-25-32-52-48(33-38)46-17-7-9-20-51(46)55-52;1-2-12-35(13-3-1)48-43-16-8-6-14-39(43)41-30-38(25-26-44(41)48)47(37-24-20-31-10-4-5-11-33(31)28-37)36-22-18-32(19-23-36)34-21-27-46-42(29-34)40-15-7-9-17-45(40)49-46/h1-36H;1-34H;1-30H.
What are the key properties of N-(4-dibenzoselenophen-2-ylphenyl)-N-naphthalen-2-yl-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine?
N-(4-dibenzoselenophen-2-ylphenyl)-N-naphthalen-2-yl-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine has a molecular weight of 2247.39 g/mol, XLogP of 41.16, 18 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-dibenzoselenophen-2-ylphenyl)-N-naphthalen-2-yl-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-9-phenylcarbazol-3-amine;N-(4-dibenzoselenophen-2-ylphenyl)-9-phenyl-N-[4-(4-phenylphenyl)phenyl]carbazol-3-amine is sourced from PubChem (CID 160962142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).