11-dibenzofuran-2-yl-5-methylindolo[3,2-b]carbazole;11-dibenzothiophen-2-yl-5-methylindolo[3,2-b]carbazole;5-methyl-11-(9-phenylcarbazol-3-yl)indolo[3,2-b]carbazole;5-methyl-11-pyridin-4-ylindolo[3,2-b]carbazole

C123H82N10OS — CID 162098445

IUPAC11-dibenzofuran-2-yl-5-methylindolo[3,2-b]carbazole;11-dibenzothiophen-2-yl-5-methylindolo[3,2-b]carbazole;5-methyl-11-(9-phenylcarbazol-3-yl)indolo[3,2-b]carbazole;5-methyl-11-pyridin-4-ylindolo[3,2-b]carbazole
SMILESCn1c2ccccc2c2cc3c(cc21)c1ccccc1n3-c1ccc2c(c1)c1ccccc1n2-c1ccccc1.Cn1c2ccccc2c2cc3c(cc21)c1ccccc1n3-c1ccc2oc3ccccc3c2c1.Cn1c2ccccc2c2cc3c(cc21)c1ccccc1n3-c1ccc2sc3ccccc3c2c1.Cn1c2ccccc2c2cc3c(cc21)c1ccccc1n3-c1ccncc1
InChIInChI=1S/C37H25N3.C31H20N2O.C31H20N2S.C24H17N3/c1-38-32-16-8-5-13-26(32)30-23-37-31(22-36(30)38)28-15-7-10-18-34(28)40(37)25-19-20-35-29(21-25)27-14-6-9-17-33(27)39(35)24-11-3-2-4-12-24;2*1-32-26-11-5-2-8-20(26)23-18-29-24(17-28(23)32)21-9-3-6-12-27(21)33(29)19-14-15-31-25(16-19)22-10-4-7-13-30(22)34-31;1-26-21-8-4-2-6-17(21)19-15-24-20(14-23(19)26)18-7-3-5-9-22(18)27(24)16-10-12-25-13-11-16/h2-23H,1H3;2*2-18H,1H3;2-15H,1H3
InChIKeyZEOFKEPUUKUZRO-UHFFFAOYSA-N
MW1748.14 g/mol
LogP32.47
Rot. Bonds5

About 11-dibenzofuran-2-yl-5-methylindolo[3,2-b]carbazole;11-dibenzothiophen-2-yl-5-methylindolo[3,2-b]carbazole;5-methyl-11-(9-phenylcarbazol-3-yl)indolo[3,2-b]carbazole;5-methyl-11-pyridin-4-ylindolo[3,2-b]carbazole

11-dibenzofuran-2-yl-5-methylindolo[3,2-b]carbazole;11-dibenzothiophen-2-yl-5-methylindolo[3,2-b]carbazole;5-methyl-11-(9-phenylcarbazol-3-yl)indolo[3,2-b]carbazole;5-methyl-11-pyridin-4-ylindolo[3,2-b]carbazole (PubChem CID 162098445) has the molecular formula C123H82N10OS and a molecular weight of 1748.14 g/mol. Its IUPAC name is 11-dibenzofuran-2-yl-5-methylindolo[3,2-b]carbazole;11-dibenzothiophen-2-yl-5-methylindolo[3,2-b]carbazole;5-methyl-11-(9-phenylcarbazol-3-yl)indolo[3,2-b]carbazole;5-methyl-11-pyridin-4-ylindolo[3,2-b]carbazole.

Molecular Properties

Compound Name11-dibenzofuran-2-yl-5-methylindolo[3,2-b]carbazole;11-dibenzothiophen-2-yl-5-methylindolo[3,2-b]carbazole;5-methyl-11-(9-phenylcarbazol-3-yl)indolo[3,2-b]carbazole;5-methyl-11-pyridin-4-ylindolo[3,2-b]carbazole
PubChem CID162098445
Molecular FormulaC123H82N10OS
Molecular Weight1748.14 g/mol
Exact Mass1746.64
IUPAC Name11-dibenzofuran-2-yl-5-methylindolo[3,2-b]carbazole;11-dibenzothiophen-2-yl-5-methylindolo[3,2-b]carbazole;5-methyl-11-(9-phenylcarbazol-3-yl)indolo[3,2-b]carbazole;5-methyl-11-pyridin-4-ylindolo[3,2-b]carbazole
SMILESCn1c2ccccc2c2cc3c(cc21)c1ccccc1n3-c1ccc2c(c1)c1ccccc1n2-c1ccccc1.Cn1c2ccccc2c2cc3c(cc21)c1ccccc1n3-c1ccc2oc3ccccc3c2c1.Cn1c2ccccc2c2cc3c(cc21)c1ccccc1n3-c1ccc2sc3ccccc3c2c1.Cn1c2ccccc2c2cc3c(cc21)c1ccccc1n3-c1ccncc1
InChIInChI=1S/C37H25N3.C31H20N2O.C31H20N2S.C24H17N3/c1-38-32-16-8-5-13-26(32)30-23-37-31(22-36(30)38)28-15-7-10-18-34(28)40(37)25-19-20-35-29(21-25)27-14-6-9-17-33(27)39(35)24-11-3-2-4-12-24;2*1-32-26-11-5-2-8-20(26)23-18-29-24(17-28(23)32)21-9-3-6-12-27(21)33(29)19-14-15-31-25(16-19)22-10-4-7-13-30(22)34-31;1-26-21-8-4-2-6-17(21)19-15-24-20(14-23(19)26)18-7-3-5-9-22(18)27(24)16-10-12-25-13-11-16/h2-23H,1H3;2*2-18H,1H3;2-15H,1H3
InChIKeyZEOFKEPUUKUZRO-UHFFFAOYSA-N
XLogP32.47
TPSA70.40 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds5
Heavy Atoms135
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001748.14
LogP ≤ 532.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 11-dibenzofuran-2-yl-5-methylindolo[3,2-b]carbazole;11-dibenzothiophen-2-yl-5-methylindolo[3,2-b]carbazole;5-methyl-11-(9-phenylcarbazol-3-yl)indolo[3,2-b]carbazole;5-methyl-11-pyridin-4-ylindolo[3,2-b]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 11-dibenzofuran-2-yl-5-methylindolo[3,2-b]carbazole;11-dibenzothiophen-2-yl-5-methylindolo[3,2-b]carbazole;5-methyl-11-(9-phenylcarbazol-3-yl)indolo[3,2-b]carbazole;5-methyl-11-pyridin-4-ylindolo[3,2-b]carbazole?
The IUPAC name of 11-dibenzofuran-2-yl-5-methylindolo[3,2-b]carbazole;11-dibenzothiophen-2-yl-5-methylindolo[3,2-b]carbazole;5-methyl-11-(9-phenylcarbazol-3-yl)indolo[3,2-b]carbazole;5-methyl-11-pyridin-4-ylindolo[3,2-b]carbazole (CID 162098445) is 11-dibenzofuran-2-yl-5-methylindolo[3,2-b]carbazole;11-dibenzothiophen-2-yl-5-methylindolo[3,2-b]carbazole;5-methyl-11-(9-phenylcarbazol-3-yl)indolo[3,2-b]carbazole;5-methyl-11-pyridin-4-ylindolo[3,2-b]carbazole.
What is the SMILES notation for 11-dibenzofuran-2-yl-5-methylindolo[3,2-b]carbazole;11-dibenzothiophen-2-yl-5-methylindolo[3,2-b]carbazole;5-methyl-11-(9-phenylcarbazol-3-yl)indolo[3,2-b]carbazole;5-methyl-11-pyridin-4-ylindolo[3,2-b]carbazole?
The canonical SMILES for 11-dibenzofuran-2-yl-5-methylindolo[3,2-b]carbazole;11-dibenzothiophen-2-yl-5-methylindolo[3,2-b]carbazole;5-methyl-11-(9-phenylcarbazol-3-yl)indolo[3,2-b]carbazole;5-methyl-11-pyridin-4-ylindolo[3,2-b]carbazole is Cn1c2ccccc2c2cc3c(cc21)c1ccccc1n3-c1ccc2c(c1)c1ccccc1n2-c1ccccc1.Cn1c2ccccc2c2cc3c(cc21)c1ccccc1n3-c1ccc2oc3ccccc3c2c1.Cn1c2ccccc2c2cc3c(cc21)c1ccccc1n3-c1ccc2sc3ccccc3c2c1.Cn1c2ccccc2c2cc3c(cc21)c1ccccc1n3-c1ccncc1.
What is the InChIKey of 11-dibenzofuran-2-yl-5-methylindolo[3,2-b]carbazole;11-dibenzothiophen-2-yl-5-methylindolo[3,2-b]carbazole;5-methyl-11-(9-phenylcarbazol-3-yl)indolo[3,2-b]carbazole;5-methyl-11-pyridin-4-ylindolo[3,2-b]carbazole?
The InChIKey is ZEOFKEPUUKUZRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H25N3.C31H20N2O.C31H20N2S.C24H17N3/c1-38-32-16-8-5-13-26(32)30-23-37-31(22-36(30)38)28-15-7-10-18-34(28)40(37)25-19-20-35-29(21-25)27-14-6-9-17-33(27)39(35)24-11-3-2-4-12-24;2*1-32-26-11-5-2-8-20(26)23-18-29-24(17-28(23)32)21-9-3-6-12-27(21)33(29)19-14-15-31-25(16-19)22-10-4-7-13-30(22)34-31;1-26-21-8-4-2-6-17(21)19-15-24-20(14-23(19)26)18-7-3-5-9-22(18)27(24)16-10-12-25-13-11-16/h2-23H,1H3;2*2-18H,1H3;2-15H,1H3.
What are the key properties of 11-dibenzofuran-2-yl-5-methylindolo[3,2-b]carbazole;11-dibenzothiophen-2-yl-5-methylindolo[3,2-b]carbazole;5-methyl-11-(9-phenylcarbazol-3-yl)indolo[3,2-b]carbazole;5-methyl-11-pyridin-4-ylindolo[3,2-b]carbazole?
11-dibenzofuran-2-yl-5-methylindolo[3,2-b]carbazole;11-dibenzothiophen-2-yl-5-methylindolo[3,2-b]carbazole;5-methyl-11-(9-phenylcarbazol-3-yl)indolo[3,2-b]carbazole;5-methyl-11-pyridin-4-ylindolo[3,2-b]carbazole has a molecular weight of 1748.14 g/mol, XLogP of 32.47, 5 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 11-dibenzofuran-2-yl-5-methylindolo[3,2-b]carbazole;11-dibenzothiophen-2-yl-5-methylindolo[3,2-b]carbazole;5-methyl-11-(9-phenylcarbazol-3-yl)indolo[3,2-b]carbazole;5-methyl-11-pyridin-4-ylindolo[3,2-b]carbazole is sourced from PubChem (CID 162098445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).