3-(9-chlorodibenzofuran-4-yl)-9-phenylcarbazole

C30H18ClNO — CID 142624048

IUPAC3-(9-chlorodibenzofuran-4-yl)-9-phenylcarbazole
SMILESClc1cccc2oc3c(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cccc3c12
InChIInChI=1S/C30H18ClNO/c31-25-13-7-15-28-29(25)23-12-6-11-21(30(23)33-28)19-16-17-27-24(18-19)22-10-4-5-14-26(22)32(27)20-8-2-1-3-9-20/h1-18H
InChIKeyXNCKBVHKXFATFK-UHFFFAOYSA-N
MW443.93 g/mol
LogP9.00
Rot. Bonds2

About 3-(9-chlorodibenzofuran-4-yl)-9-phenylcarbazole

3-(9-chlorodibenzofuran-4-yl)-9-phenylcarbazole (PubChem CID 142624048) has the molecular formula C30H18ClNO and a molecular weight of 443.93 g/mol. Its IUPAC name is 3-(9-chlorodibenzofuran-4-yl)-9-phenylcarbazole.

Molecular Properties

Compound Name3-(9-chlorodibenzofuran-4-yl)-9-phenylcarbazole
PubChem CID142624048
Molecular FormulaC30H18ClNO
Molecular Weight443.93 g/mol
Exact Mass443.11
IUPAC Name3-(9-chlorodibenzofuran-4-yl)-9-phenylcarbazole
SMILESClc1cccc2oc3c(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cccc3c12
InChIInChI=1S/C30H18ClNO/c31-25-13-7-15-28-29(25)23-12-6-11-21(30(23)33-28)19-16-17-27-24(18-19)22-10-4-5-14-26(22)32(27)20-8-2-1-3-9-20/h1-18H
InChIKeyXNCKBVHKXFATFK-UHFFFAOYSA-N
XLogP9.00
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500443.93
LogP ≤ 59.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-dibenzofuran-4-yl-9-(9-phenylcarbazol-3-yl)carbazole
CID 170132775
3-dibenzofuran-4-yl-9-(3-dibenzofuran-4-ylphenyl)-6-(9-phenylcarbazol-3-yl)carbazole
CID 121449361
3-dibenzofuran-4-yl-9-[3-(3-dibenzofuran-4-ylcarbazol-9-yl)phenyl]carbazole
CID 71004884
9-phenyl-3-[1-(9-phenylcarbazol-3-yl)dibenzofuran-4-yl]carbazole
CID 149165800
3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole
CID 146300876
9-phenyl-3-[6-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]dibenzofuran-1-yl]carbazole
CID 163662188
2-dibenzofuran-4-yl-5,7-diphenylindolo[2,3-b]carbazole;5-(4-dibenzofuran-4-ylphenyl)-7-phenylindolo[2,3-b]carbazole;5,7-diphenyl-2-(9-phenylcarbazol-3-yl)indolo[2,3-b]carbazole
CID 160885475
3-[3-[3-(4-dibenzofuran-4-ylphenyl)phenyl]phenyl]-9-phenylcarbazole
CID 121262432
9-phenyl-3-[6-[3-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]dibenzofuran-1-yl]carbazole
CID 148610640
9-(4-carbazol-9-ylphenyl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4-dibenzofuran-4-ylphenyl)-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9,14-diphenyl-5-(9-phenylcarbazol-3-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene
CID 159165938
3-dibenzofuran-4-yl-9-(2-dibenzofuran-4-ylphenyl)-6-(9-phenylcarbazol-3-yl)carbazole
CID 177209647
3-[8-[9-(4-dibenzofuran-4-ylphenyl)carbazol-3-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 137474197

Frequently Asked Questions

What is the IUPAC name of 3-(9-chlorodibenzofuran-4-yl)-9-phenylcarbazole?
The IUPAC name of 3-(9-chlorodibenzofuran-4-yl)-9-phenylcarbazole (CID 142624048) is 3-(9-chlorodibenzofuran-4-yl)-9-phenylcarbazole.
What is the SMILES notation for 3-(9-chlorodibenzofuran-4-yl)-9-phenylcarbazole?
The canonical SMILES for 3-(9-chlorodibenzofuran-4-yl)-9-phenylcarbazole is Clc1cccc2oc3c(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cccc3c12.
What is the InChIKey of 3-(9-chlorodibenzofuran-4-yl)-9-phenylcarbazole?
The InChIKey is XNCKBVHKXFATFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H18ClNO/c31-25-13-7-15-28-29(25)23-12-6-11-21(30(23)33-28)19-16-17-27-24(18-19)22-10-4-5-14-26(22)32(27)20-8-2-1-3-9-20/h1-18H.
What are the key properties of 3-(9-chlorodibenzofuran-4-yl)-9-phenylcarbazole?
3-(9-chlorodibenzofuran-4-yl)-9-phenylcarbazole has a molecular weight of 443.93 g/mol, XLogP of 9.00, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(9-chlorodibenzofuran-4-yl)-9-phenylcarbazole is sourced from PubChem (CID 142624048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).