2-methyl-6-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-xanthene]-10-yl)chromen-4-one

C39H33NO3Si — CID 160607697

IUPAC2-methyl-6-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-xanthene]-10-yl)chromen-4-one
SMILESCc1ccc2c(c1)C1(c3ccccc3Oc3ccccc31)c1cc([Si](C)(C)C)ccc1N2c1ccc2oc(C)cc(=O)c2c1
InChIInChI=1S/C39H33NO3Si/c1-24-14-17-33-31(20-24)39(29-10-6-8-12-37(29)43-38-13-9-7-11-30(38)39)32-23-27(44(3,4)5)16-18-34(32)40(33)26-15-19-36-28(22-26)35(41)21-25(2)42-36/h6-23H,1-5H3
InChIKeyIHHNNQPGZQLVJR-UHFFFAOYSA-N
MW591.78 g/mol
LogP9.23
Rot. Bonds2

About 2-methyl-6-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-xanthene]-10-yl)chromen-4-one

2-methyl-6-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-xanthene]-10-yl)chromen-4-one (PubChem CID 160607697) has the molecular formula C39H33NO3Si and a molecular weight of 591.78 g/mol. Its IUPAC name is 2-methyl-6-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-xanthene]-10-yl)chromen-4-one.

Molecular Properties

Compound Name2-methyl-6-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-xanthene]-10-yl)chromen-4-one
PubChem CID160607697
Molecular FormulaC39H33NO3Si
Molecular Weight591.78 g/mol
Exact Mass591.22
IUPAC Name2-methyl-6-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-xanthene]-10-yl)chromen-4-one
SMILESCc1ccc2c(c1)C1(c3ccccc3Oc3ccccc31)c1cc([Si](C)(C)C)ccc1N2c1ccc2oc(C)cc(=O)c2c1
InChIInChI=1S/C39H33NO3Si/c1-24-14-17-33-31(20-24)39(29-10-6-8-12-37(29)43-38-13-9-7-11-30(38)39)32-23-27(44(3,4)5)16-18-34(32)40(33)26-15-19-36-28(22-26)35(41)21-25(2)42-36/h6-23H,1-5H3
InChIKeyIHHNNQPGZQLVJR-UHFFFAOYSA-N
XLogP9.23
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500591.78
LogP ≤ 59.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 2-methyl-6-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-xanthene]-10-yl)chromen-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-xanthene]-10-yl)-3,4-dihydro-2H-naphthalen-1-one
CID 159841201
6-(2,7-dimethylspiro[acridine-9,9'-xanthene]-10-yl)-1-benzofuran-3-one;2-methyl-7-spiro[acridine-9,9'-xanthene]-10-ylchromen-4-one;6-spiro[acridine-9,9'-xanthene]-10-yl-1-benzofuran-3-one
CID 158280613
7-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-fluorene]-10-yl)-3,4-dihydroisochromen-1-one
CID 159197609
6-(2,7-dimethylspiro[acridine-9,9'-xanthene]-10-yl)-3-methyl-1-phenylquinolin-4-one;3-methyl-1-phenyl-6-(N-phenylanilino)quinolin-4-one;3-methyl-1-phenyl-6-spiro[acridine-9,9'-thioxanthene]-10-ylquinolin-4-one;3-methyl-1-phenyl-6-spiro[acridine-9,9'-xanthene]-10-ylquinolin-4-one
CID 161206904
7-(2,7-dimethylspiro[acridine-9,9'-fluorene]-10-yl)-2,4-dimethylisoquinolin-1-one;2,4-dimethyl-7-spiro[acridine-9,9'-fluorene]-10-ylisoquinolin-1-one;2,4-dimethyl-7-spiro[acridine-9,9'-xanthene]-10-ylisoquinolin-1-one;2,4-dimethyl-7-spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]-5-ylisoquinolin-1-one;7-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2,4-dimethylisoquinolin-1-one
CID 159453482
2,7-dimethylspiro[fluorene-9,9'-xanthene]
CID 58250911
6-[3,6-bis(N-phenylanilino)carbazol-9-yl]-4-methyl-2-phenylisoquinolin-1-one;6-(3,6-diphenylcarbazol-9-yl)-4-methyl-2-phenylisoquinolin-1-one;4-methyl-6-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-fluorene]-10-yl)-2-phenylisoquinolin-1-one
CID 158449680
[4-(2-methyl-9,9-diphenyl-7-triphenylsilylacridin-10-yl)phenyl]-triphenylsilane
CID 59470047
3-(17,25-dimethyl-8-oxa-21-azapentacyclo[20.4.0.02,7.09,14.015,20]hexacosa-1(22),2,4,6,9,11,13,15(20),16,18,23,25-dodecaen-21-yl)xanthen-9-one
CID 121420467
CID 137451115
CID 137451115
6-(2,7-dimethylspiro[acridine-9,9'-fluorene]-10-yl)-2-phenyl-3H-isoindol-1-one;6-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-2-phenyl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-fluorene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[acridine-9,9'-xanthene]-10-yl-3H-isoindol-1-one;2-phenyl-6-spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole]-5-yl-3H-isoindol-1-one
CID 161189686
2-methyl-10-(4-methylphenyl)-9,9-diphenylacridine
CID 58029188

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-xanthene]-10-yl)chromen-4-one?
The IUPAC name of 2-methyl-6-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-xanthene]-10-yl)chromen-4-one (CID 160607697) is 2-methyl-6-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-xanthene]-10-yl)chromen-4-one.
What is the SMILES notation for 2-methyl-6-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-xanthene]-10-yl)chromen-4-one?
The canonical SMILES for 2-methyl-6-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-xanthene]-10-yl)chromen-4-one is Cc1ccc2c(c1)C1(c3ccccc3Oc3ccccc31)c1cc([Si](C)(C)C)ccc1N2c1ccc2oc(C)cc(=O)c2c1.
What is the InChIKey of 2-methyl-6-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-xanthene]-10-yl)chromen-4-one?
The InChIKey is IHHNNQPGZQLVJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H33NO3Si/c1-24-14-17-33-31(20-24)39(29-10-6-8-12-37(29)43-38-13-9-7-11-30(38)39)32-23-27(44(3,4)5)16-18-34(32)40(33)26-15-19-36-28(22-26)35(41)21-25(2)42-36/h6-23H,1-5H3.
What are the key properties of 2-methyl-6-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-xanthene]-10-yl)chromen-4-one?
2-methyl-6-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-xanthene]-10-yl)chromen-4-one has a molecular weight of 591.78 g/mol, XLogP of 9.23, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(2-methyl-7-trimethylsilylspiro[acridine-9,9'-xanthene]-10-yl)chromen-4-one is sourced from PubChem (CID 160607697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).