9-(8-bromo-6,11-dihydrotetracen-2-yl)carbazole

C30H20BrN — CID 139329518

IUPAC9-(8-bromo-6,11-dihydrotetracen-2-yl)carbazole
SMILESBrc1ccc2c(c1)Cc1cc3ccc(-n4c5ccccc5c5ccccc54)cc3cc1C2
InChIInChI=1S/C30H20BrN/c31-25-11-9-19-13-22-16-24-18-26(12-10-20(24)14-21(22)15-23(19)17-25)32-29-7-3-1-5-27(29)28-6-2-4-8-30(28)32/h1-12,14,16-18H,13,15H2
InChIKeyNPSXJDUHMVPNKH-UHFFFAOYSA-N
MW474.40 g/mol
LogP8.19
Rot. Bonds1

About 9-(8-bromo-6,11-dihydrotetracen-2-yl)carbazole

9-(8-bromo-6,11-dihydrotetracen-2-yl)carbazole (PubChem CID 139329518) has the molecular formula C30H20BrN and a molecular weight of 474.40 g/mol. Its IUPAC name is 9-(8-bromo-6,11-dihydrotetracen-2-yl)carbazole.

Molecular Properties

Compound Name9-(8-bromo-6,11-dihydrotetracen-2-yl)carbazole
PubChem CID139329518
Molecular FormulaC30H20BrN
Molecular Weight474.40 g/mol
Exact Mass473.08
IUPAC Name9-(8-bromo-6,11-dihydrotetracen-2-yl)carbazole
SMILESBrc1ccc2c(c1)Cc1cc3ccc(-n4c5ccccc5c5ccccc54)cc3cc1C2
InChIInChI=1S/C30H20BrN/c31-25-11-9-19-13-22-16-24-18-26(12-10-20(24)14-21(22)15-23(19)17-25)32-29-7-3-1-5-27(29)28-6-2-4-8-30(28)32/h1-12,14,16-18H,13,15H2
InChIKeyNPSXJDUHMVPNKH-UHFFFAOYSA-N
XLogP8.19
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500474.40
LogP ≤ 58.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-(8-bromo-6,11-dihydrotetracen-2-yl)-1-methylcarbazole
CID 139329515
9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)-6,11-dihydrotetracen-2-yl]carbazole
CID 139329534
9-[8-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-5,12-dihydrotetracen-2-yl]carbazole
CID 139335327
9-[8-(3-phenyl-2-benzothiophen-1-yl)-5,12-dihydrotetracen-2-yl]carbazole
CID 139335239
9-[6-bromo-7-(3-bromo-6-carbazol-9-ylnaphthalen-2-yl)naphthalen-2-yl]carbazole
CID 166033097
3,6-di(carbazol-9-yl)-9-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)-5,12-dihydrotetracen-2-yl]carbazole
CID 139335356
9-[8-(2,6-diphenylpyrimidin-4-yl)-5,12-dihydrotetracen-2-yl]carbazole
CID 139335308
9-(6-carbazol-9-yl-9H-fluoren-3-yl)carbazole
CID 59464809
CID 157405970
CID 157405970
2,6-dibromo-9-naphthalen-2-ylcarbazole
CID 126674108
9H-carbazole;3,6-dibromo-9-naphthalen-2-ylcarbazole;3,6-di(carbazol-9-yl)-9-naphthalen-2-ylcarbazole
CID 161042085
2-bromo-9-(9-phenylcarbazol-2-yl)carbazole
CID 167514320

Frequently Asked Questions

What is the IUPAC name of 9-(8-bromo-6,11-dihydrotetracen-2-yl)carbazole?
The IUPAC name of 9-(8-bromo-6,11-dihydrotetracen-2-yl)carbazole (CID 139329518) is 9-(8-bromo-6,11-dihydrotetracen-2-yl)carbazole.
What is the SMILES notation for 9-(8-bromo-6,11-dihydrotetracen-2-yl)carbazole?
The canonical SMILES for 9-(8-bromo-6,11-dihydrotetracen-2-yl)carbazole is Brc1ccc2c(c1)Cc1cc3ccc(-n4c5ccccc5c5ccccc54)cc3cc1C2.
What is the InChIKey of 9-(8-bromo-6,11-dihydrotetracen-2-yl)carbazole?
The InChIKey is NPSXJDUHMVPNKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H20BrN/c31-25-11-9-19-13-22-16-24-18-26(12-10-20(24)14-21(22)15-23(19)17-25)32-29-7-3-1-5-27(29)28-6-2-4-8-30(28)32/h1-12,14,16-18H,13,15H2.
What are the key properties of 9-(8-bromo-6,11-dihydrotetracen-2-yl)carbazole?
9-(8-bromo-6,11-dihydrotetracen-2-yl)carbazole has a molecular weight of 474.40 g/mol, XLogP of 8.19, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(8-bromo-6,11-dihydrotetracen-2-yl)carbazole is sourced from PubChem (CID 139329518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).