1,3-bis(9-phenylcarbazol-2-yl)dibenzofuran-2-ol

C48H30N2O2 — CID 148926783

IUPAC1,3-bis(9-phenylcarbazol-2-yl)dibenzofuran-2-ol
SMILESOc1c(-c2ccc3c4ccccc4n(-c4ccccc4)c3c2)cc2oc3ccccc3c2c1-c1ccc2c3ccccc3n(-c3ccccc3)c2c1
InChIInChI=1S/C48H30N2O2/c51-48-39(30-23-25-36-34-17-7-10-20-40(34)49(42(36)27-30)32-13-3-1-4-14-32)29-45-47(38-19-9-12-22-44(38)52-45)46(48)31-24-26-37-35-18-8-11-21-41(35)50(43(37)28-31)33-15-5-2-6-16-33/h1-29,51H
InChIKeyPLDHKRNCRXNGLB-UHFFFAOYSA-N
MW666.78 g/mol
LogP12.82
Rot. Bonds4

About 1,3-bis(9-phenylcarbazol-2-yl)dibenzofuran-2-ol

1,3-bis(9-phenylcarbazol-2-yl)dibenzofuran-2-ol (PubChem CID 148926783) has the molecular formula C48H30N2O2 and a molecular weight of 666.78 g/mol. Its IUPAC name is 1,3-bis(9-phenylcarbazol-2-yl)dibenzofuran-2-ol.

Molecular Properties

Compound Name1,3-bis(9-phenylcarbazol-2-yl)dibenzofuran-2-ol
PubChem CID148926783
Molecular FormulaC48H30N2O2
Molecular Weight666.78 g/mol
Exact Mass666.23
IUPAC Name1,3-bis(9-phenylcarbazol-2-yl)dibenzofuran-2-ol
SMILESOc1c(-c2ccc3c4ccccc4n(-c4ccccc4)c3c2)cc2oc3ccccc3c2c1-c1ccc2c3ccccc3n(-c3ccccc3)c2c1
InChIInChI=1S/C48H30N2O2/c51-48-39(30-23-25-36-34-17-7-10-20-40(34)49(42(36)27-30)32-13-3-1-4-14-32)29-45-47(38-19-9-12-22-44(38)52-45)46(48)31-24-26-37-35-18-8-11-21-41(35)50(43(37)28-31)33-15-5-2-6-16-33/h1-29,51H
InChIKeyPLDHKRNCRXNGLB-UHFFFAOYSA-N
XLogP12.82
TPSA43.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500666.78
LogP ≤ 512.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

9-phenyl-2-[1-(9-phenylcarbazol-2-yl)dibenzofuran-3-yl]carbazole
CID 147550718
2-[9-(6-dibenzofuran-1-ylnaphthalen-2-yl)carbazol-2-yl]-9-phenylcarbazole
CID 126753215
3-[9-(2-dibenzofuran-1-ylphenyl)carbazol-2-yl]-9-phenylcarbazole
CID 126753266
2-(9-phenylcarbazol-2-yl)-9-[3-(4-phenylphenyl)dibenzofuran-1-yl]carbazole
CID 167201074
2-[3-(4,6-diphenylpyrimidin-2-yl)dibenzofuran-1-yl]-9-phenylcarbazole
CID 154938682
3-[1-(9-phenylcarbazol-3-yl)dibenzofuran-3-yl]-9-(4-phenylphenyl)carbazole
CID 158968251
2-[2-(10-dibenzofuran-2-ylanthracen-9-yl)phenyl]-9-phenylcarbazole
CID 155454186
2-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)dibenzofuran-1-yl]carbazole
CID 172512187
2-(9-phenylcarbazol-2-yl)-9-[3-(2-phenylphenyl)dibenzofuran-1-yl]carbazole
CID 167201075
4-[9-(2-dibenzofuran-1-ylphenyl)carbazol-2-yl]-9-phenylcarbazole
CID 166510148
2-[10-([1]benzofuro[3,2-e][1]benzofuran-1-yl)anthracen-9-yl]-9-phenylcarbazole
CID 176743582
3-(9-phenylcarbazol-3-yl)-9-[1-(4-triphenylen-2-ylphenyl)dibenzofuran-3-yl]carbazole
CID 163907956

Frequently Asked Questions

What is the IUPAC name of 1,3-bis(9-phenylcarbazol-2-yl)dibenzofuran-2-ol?
The IUPAC name of 1,3-bis(9-phenylcarbazol-2-yl)dibenzofuran-2-ol (CID 148926783) is 1,3-bis(9-phenylcarbazol-2-yl)dibenzofuran-2-ol.
What is the SMILES notation for 1,3-bis(9-phenylcarbazol-2-yl)dibenzofuran-2-ol?
The canonical SMILES for 1,3-bis(9-phenylcarbazol-2-yl)dibenzofuran-2-ol is Oc1c(-c2ccc3c4ccccc4n(-c4ccccc4)c3c2)cc2oc3ccccc3c2c1-c1ccc2c3ccccc3n(-c3ccccc3)c2c1.
What is the InChIKey of 1,3-bis(9-phenylcarbazol-2-yl)dibenzofuran-2-ol?
The InChIKey is PLDHKRNCRXNGLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H30N2O2/c51-48-39(30-23-25-36-34-17-7-10-20-40(34)49(42(36)27-30)32-13-3-1-4-14-32)29-45-47(38-19-9-12-22-44(38)52-45)46(48)31-24-26-37-35-18-8-11-21-41(35)50(43(37)28-31)33-15-5-2-6-16-33/h1-29,51H.
What are the key properties of 1,3-bis(9-phenylcarbazol-2-yl)dibenzofuran-2-ol?
1,3-bis(9-phenylcarbazol-2-yl)dibenzofuran-2-ol has a molecular weight of 666.78 g/mol, XLogP of 12.82, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(9-phenylcarbazol-2-yl)dibenzofuran-2-ol is sourced from PubChem (CID 148926783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).