12-dibenzofuran-1-yl-5-phenylindolo[3,2-c]carbazole

C36H22N2O — CID 167029676

IUPAC12-dibenzofuran-1-yl-5-phenylindolo[3,2-c]carbazole
SMILESc1ccc(-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4cccc5oc6ccccc6c45)c23)cc1
InChIInChI=1S/C36H22N2O/c1-2-11-23(12-3-1)37-29-17-8-5-14-26(29)35-31(37)22-21-25-24-13-4-7-16-28(24)38(36(25)35)30-18-10-20-33-34(30)27-15-6-9-19-32(27)39-33/h1-22H
InChIKeyRYRSKVHMNXVNIR-UHFFFAOYSA-N
MW498.59 g/mol
LogP9.78
Rot. Bonds2

About 12-dibenzofuran-1-yl-5-phenylindolo[3,2-c]carbazole

12-dibenzofuran-1-yl-5-phenylindolo[3,2-c]carbazole (PubChem CID 167029676) has the molecular formula C36H22N2O and a molecular weight of 498.59 g/mol. Its IUPAC name is 12-dibenzofuran-1-yl-5-phenylindolo[3,2-c]carbazole.

Molecular Properties

Compound Name12-dibenzofuran-1-yl-5-phenylindolo[3,2-c]carbazole
PubChem CID167029676
Molecular FormulaC36H22N2O
Molecular Weight498.59 g/mol
Exact Mass498.17
IUPAC Name12-dibenzofuran-1-yl-5-phenylindolo[3,2-c]carbazole
SMILESc1ccc(-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4cccc5oc6ccccc6c45)c23)cc1
InChIInChI=1S/C36H22N2O/c1-2-11-23(12-3-1)37-29-17-8-5-14-26(29)35-31(37)22-21-25-24-13-4-7-16-28(24)38(36(25)35)30-18-10-20-33-34(30)27-15-6-9-19-32(27)39-33/h1-22H
InChIKeyRYRSKVHMNXVNIR-UHFFFAOYSA-N
XLogP9.78
TPSA23.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms39
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500498.59
LogP ≤ 59.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

15-dibenzofuran-1-yl-10,20-diphenyl-10,15,20-triazaheptacyclo[14.11.0.02,14.03,11.04,9.019,27.021,26]heptacosa-1(16),2(14),3(11),4,6,8,12,17,19(27),21,23,25-dodecaene
CID 174349977
15,24-diphenyl-6-oxa-15,24-diazaheptacyclo[14.11.0.02,14.05,13.07,12.017,25.018,23]heptacosa-1(16),2(14),3,5(13),7,9,11,17(25),18,20,22,26-dodecaene
CID 126679131
9-dibenzofuran-1-yl-24-phenyl-9,24-diazahexacyclo[11.11.0.02,10.03,8.014,23.016,21]tetracosa-1(13),2(10),3,5,7,11,14,16,18,20,22-undecaene
CID 122465457
9-dibenzofuran-1-yl-18,27-diphenyl-9,18,27-triazaheptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1,3,5,7,10,12,14,16,19,21,23,25-dodecaene
CID 138729692
12-dibenzofuran-1-yl-5-dibenzofuran-4-ylindolo[3,2-c]carbazole
CID 168744311
15,24-diphenyl-10-oxa-15,24-diazaheptacyclo[14.11.0.02,14.03,11.04,9.017,25.018,23]heptacosa-1(16),2(14),3(11),4,6,8,12,17(25),18,20,22,26-dodecaene
CID 126679108
12-phenyl-5-(9-phenylcarbazol-1-yl)indolo[3,2-c]carbazole
CID 130417453
3-dibenzofuran-1-yl-22-phenyl-3,22-diazahexacyclo[11.11.0.02,10.04,9.015,23.016,21]tetracosa-1(24),2(10),4,6,8,11,13,15(23),16,18,20-undecaene
CID 122465438
5,12-diphenylindolo[3,2-c]carbazole
CID 22105108
9-dibenzofuran-1-yl-12-phenyl-9,12-diazaoctacyclo[18.12.0.02,10.03,8.011,19.013,18.021,26.027,32]dotriaconta-1(20),2(10),3,5,7,11(19),13,15,17,21,23,25,27,29,31-pentadecaene
CID 134369922
12-dibenzofuran-4-yl-5-(4-phenylphenyl)indolo[3,2-c]carbazole
CID 163757322
15,24-diphenyl-12-oxa-15,24-diazaheptacyclo[14.11.0.02,14.05,13.06,11.017,25.018,23]heptacosa-1(16),2(14),3,5(13),6,8,10,17(25),18,20,22,26-dodecaene
CID 126679111

Frequently Asked Questions

What is the IUPAC name of 12-dibenzofuran-1-yl-5-phenylindolo[3,2-c]carbazole?
The IUPAC name of 12-dibenzofuran-1-yl-5-phenylindolo[3,2-c]carbazole (CID 167029676) is 12-dibenzofuran-1-yl-5-phenylindolo[3,2-c]carbazole.
What is the SMILES notation for 12-dibenzofuran-1-yl-5-phenylindolo[3,2-c]carbazole?
The canonical SMILES for 12-dibenzofuran-1-yl-5-phenylindolo[3,2-c]carbazole is c1ccc(-n2c3ccccc3c3c2ccc2c4ccccc4n(-c4cccc5oc6ccccc6c45)c23)cc1.
What is the InChIKey of 12-dibenzofuran-1-yl-5-phenylindolo[3,2-c]carbazole?
The InChIKey is RYRSKVHMNXVNIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H22N2O/c1-2-11-23(12-3-1)37-29-17-8-5-14-26(29)35-31(37)22-21-25-24-13-4-7-16-28(24)38(36(25)35)30-18-10-20-33-34(30)27-15-6-9-19-32(27)39-33/h1-22H.
What are the key properties of 12-dibenzofuran-1-yl-5-phenylindolo[3,2-c]carbazole?
12-dibenzofuran-1-yl-5-phenylindolo[3,2-c]carbazole has a molecular weight of 498.59 g/mol, XLogP of 9.78, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 12-dibenzofuran-1-yl-5-phenylindolo[3,2-c]carbazole is sourced from PubChem (CID 167029676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).