6,12-dibromo-5,11-dihydroindeno[1,2-b]carbazole

C19H11Br2N — CID 159885626

IUPAC6,12-dibromo-5,11-dihydroindeno[1,2-b]carbazole
SMILESBrc1c2c(c(Br)c3c1[nH]c1ccccc13)Cc1ccccc1-2
InChIInChI=1S/C19H11Br2N/c20-17-13-9-10-5-1-2-6-11(10)15(13)18(21)19-16(17)12-7-3-4-8-14(12)22-19/h1-8,22H,9H2
InChIKeyXSMVKCLQUKQADS-UHFFFAOYSA-N
MW413.11 g/mol
LogP6.42
Rot. Bonds

About 6,12-dibromo-5,11-dihydroindeno[1,2-b]carbazole

6,12-dibromo-5,11-dihydroindeno[1,2-b]carbazole (PubChem CID 159885626) has the molecular formula C19H11Br2N and a molecular weight of 413.11 g/mol. Its IUPAC name is 6,12-dibromo-5,11-dihydroindeno[1,2-b]carbazole.

Molecular Properties

Compound Name6,12-dibromo-5,11-dihydroindeno[1,2-b]carbazole
PubChem CID159885626
Molecular FormulaC19H11Br2N
Molecular Weight413.11 g/mol
Exact Mass410.93
IUPAC Name6,12-dibromo-5,11-dihydroindeno[1,2-b]carbazole
SMILESBrc1c2c(c(Br)c3c1[nH]c1ccccc13)Cc1ccccc1-2
InChIInChI=1S/C19H11Br2N/c20-17-13-9-10-5-1-2-6-11(10)15(13)18(21)19-16(17)12-7-3-4-8-14(12)22-19/h1-8,22H,9H2
InChIKeyXSMVKCLQUKQADS-UHFFFAOYSA-N
XLogP6.42
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500413.11
LogP ≤ 56.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

9-azaheptacyclo[18.7.0.02,10.03,8.011,19.012,17.022,27]heptacosa-1,3,5,7,10,12,14,16,19,22,24,26-dodecaene
CID 158392465
3-azahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1(16),2(10),4,6,8,11(15),17,19,21-nonaene-12,14-dione
CID 58434746
1,2,3,4-tetrabromo-9H-carbazole
CID 70631482
7,12-dihydroindeno[1,2-a]carbazole
CID 58472013
18-phenyl-9,18-diazaheptacyclo[18.7.0.02,10.03,8.011,19.012,17.022,27]heptacosa-1(20),2(10),3,5,7,11(19),12,14,16,22,24,26-dodecaene
CID 144725899
bis(1,2,3,4-tetrabromo-9H-fluorene);carbonate
CID 19940173
9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;ethane
CID 145125960
5,10-dihydroindeno[1,2-b]indole;ethane
CID 143208166
9H-carbazole;bis(9H-fluorene)
CID 158703465
2-(9H-fluoren-1-yl)-3,4-dimethyl-1-phenyl-9H-carbazole
CID 175536427
2-(9H-fluoren-1-yl)-9H-carbazol-1-amine
CID 172636197
19-bromo-3,13-diazahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1(16),2(10),4,6,8,11(15),17(22),18,20-nonaen-12-one
CID 19711264

Frequently Asked Questions

What is the IUPAC name of 6,12-dibromo-5,11-dihydroindeno[1,2-b]carbazole?
The IUPAC name of 6,12-dibromo-5,11-dihydroindeno[1,2-b]carbazole (CID 159885626) is 6,12-dibromo-5,11-dihydroindeno[1,2-b]carbazole.
What is the SMILES notation for 6,12-dibromo-5,11-dihydroindeno[1,2-b]carbazole?
The canonical SMILES for 6,12-dibromo-5,11-dihydroindeno[1,2-b]carbazole is Brc1c2c(c(Br)c3c1[nH]c1ccccc13)Cc1ccccc1-2.
What is the InChIKey of 6,12-dibromo-5,11-dihydroindeno[1,2-b]carbazole?
The InChIKey is XSMVKCLQUKQADS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11Br2N/c20-17-13-9-10-5-1-2-6-11(10)15(13)18(21)19-16(17)12-7-3-4-8-14(12)22-19/h1-8,22H,9H2.
What are the key properties of 6,12-dibromo-5,11-dihydroindeno[1,2-b]carbazole?
6,12-dibromo-5,11-dihydroindeno[1,2-b]carbazole has a molecular weight of 413.11 g/mol, XLogP of 6.42, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6,12-dibromo-5,11-dihydroindeno[1,2-b]carbazole is sourced from PubChem (CID 159885626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).