bis(9H-carbazole);dibenzofuran;dibenzothiophene;bis(9,10-dihydroacridine);ethane;bis(9H-thioxanthene);bis(9H-xanthene)

C146H156N4O3S3 — CID 161350194

IUPACbis(9H-carbazole);dibenzofuran;dibenzothiophene;bis(9,10-dihydroacridine);ethane;bis(9H-thioxanthene);bis(9H-xanthene)
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.c1ccc2c(c1)Cc1ccccc1N2.c1ccc2c(c1)Cc1ccccc1N2.c1ccc2c(c1)Cc1ccccc1O2.c1ccc2c(c1)Cc1ccccc1O2.c1ccc2c(c1)Cc1ccccc1S2.c1ccc2c(c1)Cc1ccccc1S2.c1ccc2c(c1)[nH]c1ccccc12.c1ccc2c(c1)[nH]c1ccccc12.c1ccc2c(c1)oc1ccccc12.c1ccc2c(c1)sc1ccccc12
InChIInChI=1S/2C13H11N.2C13H10O.2C13H10S.2C12H9N.C12H8O.C12H8S.10C2H6/c6*1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12;4*1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;10*1-2/h2*1-8,14H,9H2;4*1-8H,9H2;2*1-8,13H;2*1-8H;10*1-2H3
InChIKeyVNVGYBAMJHAQKH-UHFFFAOYSA-N
MW2111.08 g/mol
LogP45.46
Rot. Bonds

About bis(9H-carbazole);dibenzofuran;dibenzothiophene;bis(9,10-dihydroacridine);ethane;bis(9H-thioxanthene);bis(9H-xanthene)

bis(9H-carbazole);dibenzofuran;dibenzothiophene;bis(9,10-dihydroacridine);ethane;bis(9H-thioxanthene);bis(9H-xanthene) (PubChem CID 161350194) has the molecular formula C146H156N4O3S3 and a molecular weight of 2111.08 g/mol. Its IUPAC name is bis(9H-carbazole);dibenzofuran;dibenzothiophene;bis(9,10-dihydroacridine);ethane;bis(9H-thioxanthene);bis(9H-xanthene).

Molecular Properties

Compound Namebis(9H-carbazole);dibenzofuran;dibenzothiophene;bis(9,10-dihydroacridine);ethane;bis(9H-thioxanthene);bis(9H-xanthene)
PubChem CID161350194
Molecular FormulaC146H156N4O3S3
Molecular Weight2111.08 g/mol
Exact Mass2109.13
IUPAC Namebis(9H-carbazole);dibenzofuran;dibenzothiophene;bis(9,10-dihydroacridine);ethane;bis(9H-thioxanthene);bis(9H-xanthene)
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.c1ccc2c(c1)Cc1ccccc1N2.c1ccc2c(c1)Cc1ccccc1N2.c1ccc2c(c1)Cc1ccccc1O2.c1ccc2c(c1)Cc1ccccc1O2.c1ccc2c(c1)Cc1ccccc1S2.c1ccc2c(c1)Cc1ccccc1S2.c1ccc2c(c1)[nH]c1ccccc12.c1ccc2c(c1)[nH]c1ccccc12.c1ccc2c(c1)oc1ccccc12.c1ccc2c(c1)sc1ccccc12
InChIInChI=1S/2C13H11N.2C13H10O.2C13H10S.2C12H9N.C12H8O.C12H8S.10C2H6/c6*1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12;4*1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;10*1-2/h2*1-8,14H,9H2;4*1-8H,9H2;2*1-8,13H;2*1-8H;10*1-2H3
InChIKeyVNVGYBAMJHAQKH-UHFFFAOYSA-N
XLogP45.46
TPSA87.24 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms156
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002111.08
LogP ≤ 545.46
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Analyze bis(9H-carbazole);dibenzofuran;dibenzothiophene;bis(9,10-dihydroacridine);ethane;bis(9H-thioxanthene);bis(9H-xanthene) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E)-4-[3,5-difluoro-4-[6-fluoro-2-(2-fluoro-2-methylpropyl)-3-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]phenyl]but-3-en-2-one;(E)-4-[3,5-difluoro-4-[2-(2-fluoro-2-methylpropyl)-3-methyl-3,4-dihydro-1H-[1]benzofuro[2,3-c]pyridin-1-yl]phenyl]but-3-en-2-one;(E)-4-[3,5-difluoro-4-[2-(2-fluoro-2-methylpropyl)-3-methyl-3,4-dihydro-1H-[1]benzothiolo[2,3-c]pyridin-1-yl]phenyl]but-3-en-2-one;(E)-4-[4-[2-(2,2-difluoropropyl)-3-methyl-3,4-dihydro-1H-[1]benzofuro[2,3-c]pyridin-1-yl]-3,5-difluorophenyl]but-3-en-2-one
CID 158677542
benzene;benzenesulfonylbenzene;benzylbenzene;9H-carbazole;2,5-dimethylfuran;2,5-dimethyl-1H-pyrrole;2,5-dimethylthiophene;1,1-diphenylethylbenzene;diphenylmethanone;ethane;(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)benzene;phenoxybenzene;(1-phenylcyclohexyl)benzene;(1-phenylcyclopentyl)benzene;2-phenylpropan-2-ylbenzene;phenylsulfanylbenzene;2,4,4-trimethyl-2-phenyl-3H-chromene;1,2,5-trimethylpyrrole
CID 160251165
3-Dibenzofuran-2-yl-6-(9-dibenzothiophen-2-yl-6-phenylcarbazol-3-yl)-9-phenylcarbazole
CID 53491596
9-[8-[8-(8-Carbazol-9-yldibenzothiophen-2-yl)dibenzofuran-2-yl]dibenzothiophen-2-yl]carbazole
CID 57653808
3-Dibenzofuran-2-yl-9-[8-(3-dibenzofuran-2-ylcarbazol-9-yl)dibenzothiophen-2-yl]carbazole
CID 57997703
9-[8-[8-[3-[8-(8-Carbazol-9-yldibenzothiophen-2-yl)dibenzofuran-2-yl]phenyl]dibenzofuran-2-yl]dibenzothiophen-2-yl]carbazole
CID 58038521
9-Phenyl-3-[8-[3-[8-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]phenyl]dibenzothiophen-2-yl]carbazole
CID 58038567
3-[2-(2-Carbazol-9-yldibenzothiophen-4-yl)dibenzofuran-4-yl]-9-phenylcarbazole
CID 58059046
9-[3-[3-Carbazol-9-yl-5-(6-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]-5-(6-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]carbazole
CID 58059072
3-[9-(4-Dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-(4-dibenzothiophen-4-ylphenyl)carbazole
CID 58511011
3-Cyclohexyl-6-[9-(3-dibenzofuran-2-ylphenyl)carbazol-3-yl]-9-dibenzothiophen-2-ylcarbazole
CID 58511015
3-[9-(4-Dibenzofuran-4-ylphenyl)-6-phenylcarbazol-3-yl]oxy-9-(4-dibenzothiophen-4-ylphenyl)-6-phenylcarbazole
CID 58511047

Frequently Asked Questions

What is the IUPAC name of bis(9H-carbazole);dibenzofuran;dibenzothiophene;bis(9,10-dihydroacridine);ethane;bis(9H-thioxanthene);bis(9H-xanthene)?
The IUPAC name of bis(9H-carbazole);dibenzofuran;dibenzothiophene;bis(9,10-dihydroacridine);ethane;bis(9H-thioxanthene);bis(9H-xanthene) (CID 161350194) is bis(9H-carbazole);dibenzofuran;dibenzothiophene;bis(9,10-dihydroacridine);ethane;bis(9H-thioxanthene);bis(9H-xanthene).
What is the SMILES notation for bis(9H-carbazole);dibenzofuran;dibenzothiophene;bis(9,10-dihydroacridine);ethane;bis(9H-thioxanthene);bis(9H-xanthene)?
The canonical SMILES for bis(9H-carbazole);dibenzofuran;dibenzothiophene;bis(9,10-dihydroacridine);ethane;bis(9H-thioxanthene);bis(9H-xanthene) is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.c1ccc2c(c1)Cc1ccccc1N2.c1ccc2c(c1)Cc1ccccc1N2.c1ccc2c(c1)Cc1ccccc1O2.c1ccc2c(c1)Cc1ccccc1O2.c1ccc2c(c1)Cc1ccccc1S2.c1ccc2c(c1)Cc1ccccc1S2.c1ccc2c(c1)[nH]c1ccccc12.c1ccc2c(c1)[nH]c1ccccc12.c1ccc2c(c1)oc1ccccc12.c1ccc2c(c1)sc1ccccc12.
What is the InChIKey of bis(9H-carbazole);dibenzofuran;dibenzothiophene;bis(9,10-dihydroacridine);ethane;bis(9H-thioxanthene);bis(9H-xanthene)?
The InChIKey is VNVGYBAMJHAQKH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C13H11N.2C13H10O.2C13H10S.2C12H9N.C12H8O.C12H8S.10C2H6/c6*1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12;4*1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;10*1-2/h2*1-8,14H,9H2;4*1-8H,9H2;2*1-8,13H;2*1-8H;10*1-2H3.
What are the key properties of bis(9H-carbazole);dibenzofuran;dibenzothiophene;bis(9,10-dihydroacridine);ethane;bis(9H-thioxanthene);bis(9H-xanthene)?
bis(9H-carbazole);dibenzofuran;dibenzothiophene;bis(9,10-dihydroacridine);ethane;bis(9H-thioxanthene);bis(9H-xanthene) has a molecular weight of 2111.08 g/mol, XLogP of 45.46, 0 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for bis(9H-carbazole);dibenzofuran;dibenzothiophene;bis(9,10-dihydroacridine);ethane;bis(9H-thioxanthene);bis(9H-xanthene) is sourced from PubChem (CID 161350194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).