2-(4-bromophenyl)-5-phenyl-1,3,4-oxadiazole;N,9-diphenylcarbazol-3-amine;N,9-diphenyl-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]carbazol-3-amine;hydroperoxyperoxyperoxyperoxyperoxy hypobromite

C76H54Br2N8O13 — CID 160663831

IUPAC2-(4-bromophenyl)-5-phenyl-1,3,4-oxadiazole;N,9-diphenylcarbazol-3-amine;N,9-diphenyl-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]carbazol-3-amine;hydroperoxyperoxyperoxyperoxyperoxy hypobromite
SMILESBrc1ccc(-c2nnc(-c3ccccc3)o2)cc1.OOOOOOOOOOOBr.c1ccc(-c2nnc(-c3ccc(N(c4ccccc4)c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)o2)cc1.c1ccc(Nc2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1
InChIInChI=1S/C38H26N4O.C24H18N2.C14H9BrN2O.BrHO11/c1-4-12-27(13-5-1)37-39-40-38(43-37)28-20-22-31(23-21-28)41(29-14-6-2-7-15-29)32-24-25-36-34(26-32)33-18-10-11-19-35(33)42(36)30-16-8-3-9-17-30;1-3-9-18(10-4-1)25-19-15-16-24-22(17-19)21-13-7-8-14-23(21)26(24)20-11-5-2-6-12-20;15-12-8-6-11(7-9-12)14-17-16-13(18-14)10-4-2-1-3-5-10;1-3-5-7-9-11-12-10-8-6-4-2/h1-26H;1-17,25H;1-9H;2H
InChIKeyRMAKINLAZHLCBI-UHFFFAOYSA-N
MW1447.12 g/mol
LogP20.83
Rot. Bonds20

About 2-(4-bromophenyl)-5-phenyl-1,3,4-oxadiazole;N,9-diphenylcarbazol-3-amine;N,9-diphenyl-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]carbazol-3-amine;hydroperoxyperoxyperoxyperoxyperoxy hypobromite

2-(4-bromophenyl)-5-phenyl-1,3,4-oxadiazole;N,9-diphenylcarbazol-3-amine;N,9-diphenyl-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]carbazol-3-amine;hydroperoxyperoxyperoxyperoxyperoxy hypobromite (PubChem CID 160663831) has the molecular formula C76H54Br2N8O13 and a molecular weight of 1447.12 g/mol. Its IUPAC name is 2-(4-bromophenyl)-5-phenyl-1,3,4-oxadiazole;N,9-diphenylcarbazol-3-amine;N,9-diphenyl-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]carbazol-3-amine;hydroperoxyperoxyperoxyperoxyperoxy hypobromite.

Molecular Properties

Compound Name2-(4-bromophenyl)-5-phenyl-1,3,4-oxadiazole;N,9-diphenylcarbazol-3-amine;N,9-diphenyl-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]carbazol-3-amine;hydroperoxyperoxyperoxyperoxyperoxy hypobromite
PubChem CID160663831
Molecular FormulaC76H54Br2N8O13
Molecular Weight1447.12 g/mol
Exact Mass1444.22
IUPAC Name2-(4-bromophenyl)-5-phenyl-1,3,4-oxadiazole;N,9-diphenylcarbazol-3-amine;N,9-diphenyl-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]carbazol-3-amine;hydroperoxyperoxyperoxyperoxyperoxy hypobromite
SMILESBrc1ccc(-c2nnc(-c3ccccc3)o2)cc1.OOOOOOOOOOOBr.c1ccc(-c2nnc(-c3ccc(N(c4ccccc4)c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)o2)cc1.c1ccc(Nc2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1
InChIInChI=1S/C38H26N4O.C24H18N2.C14H9BrN2O.BrHO11/c1-4-12-27(13-5-1)37-39-40-38(43-37)28-20-22-31(23-21-28)41(29-14-6-2-7-15-29)32-24-25-36-34(26-32)33-18-10-11-19-35(33)42(36)30-16-8-3-9-17-30;1-3-9-18(10-4-1)25-19-15-16-24-22(17-19)21-13-7-8-14-23(21)26(24)20-11-5-2-6-12-20;15-12-8-6-11(7-9-12)14-17-16-13(18-14)10-4-2-1-3-5-10;1-3-5-7-9-11-12-10-8-6-4-2/h1-26H;1-17,25H;1-9H;2H
InChIKeyRMAKINLAZHLCBI-UHFFFAOYSA-N
XLogP20.83
TPSA215.50 Ų
H-Bond Donors2
H-Bond Acceptors21
Rotatable Bonds20
Heavy Atoms99
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001447.12
LogP ≤ 520.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1021

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Analyze 2-(4-bromophenyl)-5-phenyl-1,3,4-oxadiazole;N,9-diphenylcarbazol-3-amine;N,9-diphenyl-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]carbazol-3-amine;hydroperoxyperoxyperoxyperoxyperoxy hypobromite with MolForge

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Related Compounds

2-(4-bromophenyl)-9-phenylcarbazole;9-phenyl-N-[4-(9-phenylcarbazol-2-yl)phenyl]-N-(4-phenylphenyl)carbazol-3-amine;9-phenyl-N-(4-phenylphenyl)carbazol-3-amine
CID 160525115
9-phenyl-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-N-(3-phenylphenyl)carbazol-3-amine
CID 58903542
N,9-diphenyl-N-[4-[5-(3-phenylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]carbazol-3-amine
CID 58903714
9-[4-(4-bromophenyl)phenyl]-10-phenylanthracene;N-phenyl-4-[4-(10-phenylanthracen-9-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline;N-phenyl-4-(9-phenylcarbazol-3-yl)aniline
CID 159237953
N-[4-[4-(4-bromophenyl)phenyl]phenyl]-N,9-diphenylcarbazol-3-amine
CID 121328111
N-(4-bromophenyl)-N-phenyl-4-(9-phenylcarbazol-3-yl)aniline
CID 66584191
3-bromo-9-phenylcarbazole;N,9-diphenylcarbazol-3-amine
CID 161460507
N-[4-(4-anilinophenyl)phenyl]-9-(4-fluorophenyl)-N-phenylcarbazol-3-amine
CID 138528996
N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;1-N,1-N,4-N-triphenyl-4-N-[4-(4-phenyl-N-[4-(N-phenylanilino)phenyl]anilino)phenyl]benzene-1,4-diamine
CID 159618005
1-bromo-4-phenylbenzene;N-[4-(3-carbazol-9-ylphenyl)phenyl]-3-phenanthren-9-ylaniline;N-[4-(3-carbazol-9-ylphenyl)phenyl]-3-phenanthren-9-yl-N-(4-phenylphenyl)aniline
CID 158034274
4-naphthalen-2-yl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]aniline
CID 59489386
2-(4-bromophenyl)-9,10-diphenylanthracene;4-carbazol-9-yl-N-phenylaniline;N-(4-carbazol-9-ylphenyl)-4-(9,10-diphenylanthracen-2-yl)-N-phenylaniline;methane
CID 159608625

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-5-phenyl-1,3,4-oxadiazole;N,9-diphenylcarbazol-3-amine;N,9-diphenyl-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]carbazol-3-amine;hydroperoxyperoxyperoxyperoxyperoxy hypobromite?
The IUPAC name of 2-(4-bromophenyl)-5-phenyl-1,3,4-oxadiazole;N,9-diphenylcarbazol-3-amine;N,9-diphenyl-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]carbazol-3-amine;hydroperoxyperoxyperoxyperoxyperoxy hypobromite (CID 160663831) is 2-(4-bromophenyl)-5-phenyl-1,3,4-oxadiazole;N,9-diphenylcarbazol-3-amine;N,9-diphenyl-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]carbazol-3-amine;hydroperoxyperoxyperoxyperoxyperoxy hypobromite.
What is the SMILES notation for 2-(4-bromophenyl)-5-phenyl-1,3,4-oxadiazole;N,9-diphenylcarbazol-3-amine;N,9-diphenyl-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]carbazol-3-amine;hydroperoxyperoxyperoxyperoxyperoxy hypobromite?
The canonical SMILES for 2-(4-bromophenyl)-5-phenyl-1,3,4-oxadiazole;N,9-diphenylcarbazol-3-amine;N,9-diphenyl-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]carbazol-3-amine;hydroperoxyperoxyperoxyperoxyperoxy hypobromite is Brc1ccc(-c2nnc(-c3ccccc3)o2)cc1.OOOOOOOOOOOBr.c1ccc(-c2nnc(-c3ccc(N(c4ccccc4)c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)o2)cc1.c1ccc(Nc2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1.
What is the InChIKey of 2-(4-bromophenyl)-5-phenyl-1,3,4-oxadiazole;N,9-diphenylcarbazol-3-amine;N,9-diphenyl-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]carbazol-3-amine;hydroperoxyperoxyperoxyperoxyperoxy hypobromite?
The InChIKey is RMAKINLAZHLCBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H26N4O.C24H18N2.C14H9BrN2O.BrHO11/c1-4-12-27(13-5-1)37-39-40-38(43-37)28-20-22-31(23-21-28)41(29-14-6-2-7-15-29)32-24-25-36-34(26-32)33-18-10-11-19-35(33)42(36)30-16-8-3-9-17-30;1-3-9-18(10-4-1)25-19-15-16-24-22(17-19)21-13-7-8-14-23(21)26(24)20-11-5-2-6-12-20;15-12-8-6-11(7-9-12)14-17-16-13(18-14)10-4-2-1-3-5-10;1-3-5-7-9-11-12-10-8-6-4-2/h1-26H;1-17,25H;1-9H;2H.
What are the key properties of 2-(4-bromophenyl)-5-phenyl-1,3,4-oxadiazole;N,9-diphenylcarbazol-3-amine;N,9-diphenyl-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]carbazol-3-amine;hydroperoxyperoxyperoxyperoxyperoxy hypobromite?
2-(4-bromophenyl)-5-phenyl-1,3,4-oxadiazole;N,9-diphenylcarbazol-3-amine;N,9-diphenyl-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]carbazol-3-amine;hydroperoxyperoxyperoxyperoxyperoxy hypobromite has a molecular weight of 1447.12 g/mol, XLogP of 20.83, 20 rotatable bonds, 2 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-5-phenyl-1,3,4-oxadiazole;N,9-diphenylcarbazol-3-amine;N,9-diphenyl-N-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]carbazol-3-amine;hydroperoxyperoxyperoxyperoxyperoxy hypobromite is sourced from PubChem (CID 160663831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).