9-phenyl-3-(9-phenylxanthen-9-yl)carbazole

C37H25NO — CID 134164714

IUPAC9-phenyl-3-(9-phenylxanthen-9-yl)carbazole
SMILESc1ccc(-n2c3ccccc3c3cc(C4(c5ccccc5)c5ccccc5Oc5ccccc54)ccc32)cc1
InChIInChI=1S/C37H25NO/c1-3-13-26(14-4-1)37(31-18-8-11-21-35(31)39-36-22-12-9-19-32(36)37)27-23-24-34-30(25-27)29-17-7-10-20-33(29)38(34)28-15-5-2-6-16-28/h1-25H
InChIKeyIXGBEXZTOFCYCC-UHFFFAOYSA-N
MW499.61 g/mol
LogP9.27
Rot. Bonds3

About 9-phenyl-3-(9-phenylxanthen-9-yl)carbazole

9-phenyl-3-(9-phenylxanthen-9-yl)carbazole (PubChem CID 134164714) has the molecular formula C37H25NO and a molecular weight of 499.61 g/mol. Its IUPAC name is 9-phenyl-3-(9-phenylxanthen-9-yl)carbazole.

Molecular Properties

Compound Name9-phenyl-3-(9-phenylxanthen-9-yl)carbazole
PubChem CID134164714
Molecular FormulaC37H25NO
Molecular Weight499.61 g/mol
Exact Mass499.19
IUPAC Name9-phenyl-3-(9-phenylxanthen-9-yl)carbazole
SMILESc1ccc(-n2c3ccccc3c3cc(C4(c5ccccc5)c5ccccc5Oc5ccccc54)ccc32)cc1
InChIInChI=1S/C37H25NO/c1-3-13-26(14-4-1)37(31-18-8-11-21-35(31)39-36-22-12-9-19-32(36)37)27-23-24-34-30(25-27)29-17-7-10-20-33(29)38(34)28-15-5-2-6-16-28/h1-25H
InChIKeyIXGBEXZTOFCYCC-UHFFFAOYSA-N
XLogP9.27
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500499.61
LogP ≤ 59.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-phenyl-8-(9-phenylxanthen-9-yl)pyrido[4,3-b]indole
CID 140899019
9-phenyl-3-spiro[fluorene-9,9'-xanthene]-2-ylcarbazole
CID 177298584
8-(9,9-diphenylxanthen-2-yl)-11-phenylbenzo[a]carbazole
CID 170038799
9-phenyl-6-(9-phenylcarbazol-3-yl)-2-(9-phenylfluoren-9-yl)carbazole
CID 118145084
9-phenyl-9-(9-phenylcarbazol-3-yl)-10-[4-(9-phenylcarbazol-3-yl)phenyl]acridine
CID 146511276
9-phenyl-3-(9-phenylfluoren-9-yl)-6-[9-(3-phenylphenyl)carbazol-3-yl]carbazole
CID 121311550
9-(9-phenylcarbazol-2-yl)xanthene-9-carbaldehyde
CID 175211994
10'-phenyl-10-(9-phenylcarbazol-3-yl)spiro[21-oxa-10-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene-14,9'-acridine]
CID 134351848
3-[2,7-dibromo-9-(9-phenylcarbazol-3-yl)fluoren-9-yl]-9-phenylcarbazole
CID 102125302
9-phenyl-3-[7'-(9-phenylcarbazol-3-yl)spiro[fluorene-9,9'-xanthene]-2'-yl]carbazole
CID 167178048
2-bromo-9-phenyl-6-(9-phenylfluoren-9-yl)carbazole
CID 167214778
2-N,2-N,4-N,4-N,9-pentakis-phenyl-9-(9-phenylcarbazol-3-yl)fluorene-2,4-diamine
CID 118204439

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-3-(9-phenylxanthen-9-yl)carbazole?
The IUPAC name of 9-phenyl-3-(9-phenylxanthen-9-yl)carbazole (CID 134164714) is 9-phenyl-3-(9-phenylxanthen-9-yl)carbazole.
What is the SMILES notation for 9-phenyl-3-(9-phenylxanthen-9-yl)carbazole?
The canonical SMILES for 9-phenyl-3-(9-phenylxanthen-9-yl)carbazole is c1ccc(-n2c3ccccc3c3cc(C4(c5ccccc5)c5ccccc5Oc5ccccc54)ccc32)cc1.
What is the InChIKey of 9-phenyl-3-(9-phenylxanthen-9-yl)carbazole?
The InChIKey is IXGBEXZTOFCYCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H25NO/c1-3-13-26(14-4-1)37(31-18-8-11-21-35(31)39-36-22-12-9-19-32(36)37)27-23-24-34-30(25-27)29-17-7-10-20-33(29)38(34)28-15-5-2-6-16-28/h1-25H.
What are the key properties of 9-phenyl-3-(9-phenylxanthen-9-yl)carbazole?
9-phenyl-3-(9-phenylxanthen-9-yl)carbazole has a molecular weight of 499.61 g/mol, XLogP of 9.27, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-3-(9-phenylxanthen-9-yl)carbazole is sourced from PubChem (CID 134164714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).