2,8-bis(9H-carbazol-1-yl)-10-phenyl-5H-phenazine

C42H28N4 — CID 141471405

IUPAC2,8-bis(9H-carbazol-1-yl)-10-phenyl-5H-phenazine
SMILESc1ccc(N2c3cc(-c4cccc5c4[nH]c4ccccc45)ccc3Nc3ccc(-c4cccc5c4[nH]c4ccccc45)cc32)cc1
InChIInChI=1S/C42H28N4/c1-2-10-28(11-3-1)46-39-24-26(29-14-8-16-33-31-12-4-6-18-35(31)44-41(29)33)20-22-37(39)43-38-23-21-27(25-40(38)46)30-15-9-17-34-32-13-5-7-19-36(32)45-42(30)34/h1-25,43-45H
InChIKeyMPOYKTOLLJNUGL-UHFFFAOYSA-N
MW588.71 g/mol
LogP11.82
Rot. Bonds3

About 2,8-bis(9H-carbazol-1-yl)-10-phenyl-5H-phenazine

2,8-bis(9H-carbazol-1-yl)-10-phenyl-5H-phenazine (PubChem CID 141471405) has the molecular formula C42H28N4 and a molecular weight of 588.71 g/mol. Its IUPAC name is 2,8-bis(9H-carbazol-1-yl)-10-phenyl-5H-phenazine.

Molecular Properties

Compound Name2,8-bis(9H-carbazol-1-yl)-10-phenyl-5H-phenazine
PubChem CID141471405
Molecular FormulaC42H28N4
Molecular Weight588.71 g/mol
Exact Mass588.23
IUPAC Name2,8-bis(9H-carbazol-1-yl)-10-phenyl-5H-phenazine
SMILESc1ccc(N2c3cc(-c4cccc5c4[nH]c4ccccc45)ccc3Nc3ccc(-c4cccc5c4[nH]c4ccccc45)cc32)cc1
InChIInChI=1S/C42H28N4/c1-2-10-28(11-3-1)46-39-24-26(29-14-8-16-33-31-12-4-6-18-35(31)44-41(29)33)20-22-37(39)43-38-23-21-27(25-40(38)46)30-15-9-17-34-32-13-5-7-19-36(32)45-42(30)34/h1-25,43-45H
InChIKeyMPOYKTOLLJNUGL-UHFFFAOYSA-N
XLogP11.82
TPSA46.85 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500588.71
LogP ≤ 511.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-[4-[4-[4-(9H-carbazol-1-yl)phenyl]phenyl]phenyl]phenyl]-9H-carbazole
CID 175958773
1-(3,4-diphenylphenyl)-9H-carbazole
CID 141489388
1-(3-triphenylen-2-ylphenyl)-9H-carbazole
CID 129197617
1-[4-[4-(9H-carbazol-1-yl)-2-methylphenyl]-3-methylphenyl]-9H-carbazole
CID 159544666
1-(3-bromo-4-phenylphenyl)-9H-carbazole
CID 175063940
16-(9H-carbazol-1-yl)-20-phenyl-2,5,13,20-tetraza-1-borapentacyclo[11.7.0.02,6.07,12.014,19]icosa-3,5,7,9,11,14(19),15,17-octaene
CID 163896862
3-(9H-carbazol-1-yl)aniline
CID 67501137
1-[2-(9H-carbazol-1-yl)phenyl]-9H-carbazole
CID 66618059
1-[4-[[4-(9H-carbazol-1-yl)phenyl]-diphenylmethyl]phenyl]-9H-carbazole
CID 141146048
1-[3-(4-bromophenyl)-5-(9H-carbazol-1-yl)phenyl]-9H-carbazole
CID 67532426
1-[4-[1-[4-(9H-carbazol-1-yl)phenyl]-2,2-diphenylethenyl]phenyl]-9H-carbazole
CID 155666000
[4-(9H-carbazol-1-yl)phenyl]-triphenylsilane
CID 141080008

Frequently Asked Questions

What is the IUPAC name of 2,8-bis(9H-carbazol-1-yl)-10-phenyl-5H-phenazine?
The IUPAC name of 2,8-bis(9H-carbazol-1-yl)-10-phenyl-5H-phenazine (CID 141471405) is 2,8-bis(9H-carbazol-1-yl)-10-phenyl-5H-phenazine.
What is the SMILES notation for 2,8-bis(9H-carbazol-1-yl)-10-phenyl-5H-phenazine?
The canonical SMILES for 2,8-bis(9H-carbazol-1-yl)-10-phenyl-5H-phenazine is c1ccc(N2c3cc(-c4cccc5c4[nH]c4ccccc45)ccc3Nc3ccc(-c4cccc5c4[nH]c4ccccc45)cc32)cc1.
What is the InChIKey of 2,8-bis(9H-carbazol-1-yl)-10-phenyl-5H-phenazine?
The InChIKey is MPOYKTOLLJNUGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H28N4/c1-2-10-28(11-3-1)46-39-24-26(29-14-8-16-33-31-12-4-6-18-35(31)44-41(29)33)20-22-37(39)43-38-23-21-27(25-40(38)46)30-15-9-17-34-32-13-5-7-19-36(32)45-42(30)34/h1-25,43-45H.
What are the key properties of 2,8-bis(9H-carbazol-1-yl)-10-phenyl-5H-phenazine?
2,8-bis(9H-carbazol-1-yl)-10-phenyl-5H-phenazine has a molecular weight of 588.71 g/mol, XLogP of 11.82, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,8-bis(9H-carbazol-1-yl)-10-phenyl-5H-phenazine is sourced from PubChem (CID 141471405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).