7-[4-(4-carbazol-9-ylphenyl)phenyl]indolo[1,2-a]quinoxaline

C39H25N3 — CID 145180155

IUPAC7-[4-(4-carbazol-9-ylphenyl)phenyl]indolo[1,2-a]quinoxaline
SMILESc1ccc2c(c1)ncc1c(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)c3ccccc3n12
InChIInChI=1S/C39H25N3/c1-5-13-34-30(9-1)31-10-2-6-14-35(31)41(34)29-23-21-27(22-24-29)26-17-19-28(20-18-26)39-32-11-3-7-15-36(32)42-37-16-8-4-12-33(37)40-25-38(39)42/h1-25H
InChIKeyXRVZXCIJCXZUTG-UHFFFAOYSA-N
MW535.65 g/mol
LogP10.07
Rot. Bonds3

About 7-[4-(4-carbazol-9-ylphenyl)phenyl]indolo[1,2-a]quinoxaline

7-[4-(4-carbazol-9-ylphenyl)phenyl]indolo[1,2-a]quinoxaline (PubChem CID 145180155) has the molecular formula C39H25N3 and a molecular weight of 535.65 g/mol. Its IUPAC name is 7-[4-(4-carbazol-9-ylphenyl)phenyl]indolo[1,2-a]quinoxaline.

Molecular Properties

Compound Name7-[4-(4-carbazol-9-ylphenyl)phenyl]indolo[1,2-a]quinoxaline
PubChem CID145180155
Molecular FormulaC39H25N3
Molecular Weight535.65 g/mol
Exact Mass535.20
IUPAC Name7-[4-(4-carbazol-9-ylphenyl)phenyl]indolo[1,2-a]quinoxaline
SMILESc1ccc2c(c1)ncc1c(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)c3ccccc3n12
InChIInChI=1S/C39H25N3/c1-5-13-34-30(9-1)31-10-2-6-14-35(31)41(34)29-23-21-27(22-24-29)26-17-19-28(20-18-26)39-32-11-3-7-15-36(32)42-37-16-8-4-12-33(37)40-25-38(39)42/h1-25H
InChIKeyXRVZXCIJCXZUTG-UHFFFAOYSA-N
XLogP10.07
TPSA22.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500535.65
LogP ≤ 510.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

7-[4-[4-(6-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]indolo[1,2-a]quinoxaline
CID 145180542
7-methyl-3-[9-(4-phenylphenyl)carbazol-3-yl]indolo[1,2-a]quinoxaline
CID 163957549
9-[4-[4-[4-[4-[4-(4-carbazol-9-ylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 118041201
9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole
CID 135323607
9-[4-(10-quinolin-3-ylanthracen-9-yl)phenyl]carbazole
CID 58273441
7-[3-[2,6-bis(4-pyridin-4-ylphenyl)-4-pyridinyl]phenyl]indolo[1,2-a]quinoxaline
CID 145180348
9-[4-[10-[10-(4-carbazol-9-ylphenyl)anthracen-9-yl]anthracen-9-yl]phenyl]carbazole
CID 58971557
9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;ethane
CID 143126318
9-[4-[4-(4-carbazol-9-ylphenyl)-2,3,5,6-tetramethylphenyl]phenyl]carbazole
CID 58939501
9-[4-[4-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]carbazole
CID 122425259
9-[4-[4-[4-[4-[4-[4-(4-carbazol-9-ylphenyl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenyl]phenyl]carbazole
CID 59779621
5-(3-indolo[1,2-a]quinoxalin-7-ylphenyl)-11,11-diphenylindeno[1,2-b]carbazole
CID 145180297

Frequently Asked Questions

What is the IUPAC name of 7-[4-(4-carbazol-9-ylphenyl)phenyl]indolo[1,2-a]quinoxaline?
The IUPAC name of 7-[4-(4-carbazol-9-ylphenyl)phenyl]indolo[1,2-a]quinoxaline (CID 145180155) is 7-[4-(4-carbazol-9-ylphenyl)phenyl]indolo[1,2-a]quinoxaline.
What is the SMILES notation for 7-[4-(4-carbazol-9-ylphenyl)phenyl]indolo[1,2-a]quinoxaline?
The canonical SMILES for 7-[4-(4-carbazol-9-ylphenyl)phenyl]indolo[1,2-a]quinoxaline is c1ccc2c(c1)ncc1c(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)c3ccccc3n12.
What is the InChIKey of 7-[4-(4-carbazol-9-ylphenyl)phenyl]indolo[1,2-a]quinoxaline?
The InChIKey is XRVZXCIJCXZUTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H25N3/c1-5-13-34-30(9-1)31-10-2-6-14-35(31)41(34)29-23-21-27(22-24-29)26-17-19-28(20-18-26)39-32-11-3-7-15-36(32)42-37-16-8-4-12-33(37)40-25-38(39)42/h1-25H.
What are the key properties of 7-[4-(4-carbazol-9-ylphenyl)phenyl]indolo[1,2-a]quinoxaline?
7-[4-(4-carbazol-9-ylphenyl)phenyl]indolo[1,2-a]quinoxaline has a molecular weight of 535.65 g/mol, XLogP of 10.07, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[4-(4-carbazol-9-ylphenyl)phenyl]indolo[1,2-a]quinoxaline is sourced from PubChem (CID 145180155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).