8,8-diphenyl-22-oxa-8-silapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16,18,20-decaene

C32H22OSi — CID 140863420

IUPAC8,8-diphenyl-22-oxa-8-silapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16,18,20-decaene
SMILESc1ccc([Si]2(c3ccccc3)c3ccccc3-c3oc4ccccc4c3-c3ccccc32)cc1
InChIInChI=1S/C32H22OSi/c1-3-13-23(14-4-1)34(24-15-5-2-6-16-24)29-21-11-8-18-26(29)31-25-17-7-10-20-28(25)33-32(31)27-19-9-12-22-30(27)34/h1-22H
InChIKeyOWMRXLROGWTIHS-UHFFFAOYSA-N
MW450.61 g/mol
LogP5.46
Rot. Bonds2

About 8,8-diphenyl-22-oxa-8-silapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16,18,20-decaene

8,8-diphenyl-22-oxa-8-silapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16,18,20-decaene (PubChem CID 140863420) has the molecular formula C32H22OSi and a molecular weight of 450.61 g/mol. Its IUPAC name is 8,8-diphenyl-22-oxa-8-silapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16,18,20-decaene.

Molecular Properties

Compound Name8,8-diphenyl-22-oxa-8-silapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16,18,20-decaene
PubChem CID140863420
Molecular FormulaC32H22OSi
Molecular Weight450.61 g/mol
Exact Mass450.14
IUPAC Name8,8-diphenyl-22-oxa-8-silapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16,18,20-decaene
SMILESc1ccc([Si]2(c3ccccc3)c3ccccc3-c3oc4ccccc4c3-c3ccccc32)cc1
InChIInChI=1S/C32H22OSi/c1-3-13-23(14-4-1)34(24-15-5-2-6-16-24)29-21-11-8-18-26(29)31-25-17-7-10-20-28(25)33-32(31)27-19-9-12-22-30(27)34/h1-22H
InChIKeyOWMRXLROGWTIHS-UHFFFAOYSA-N
XLogP5.46
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500450.61
LogP ≤ 55.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 8,8-diphenyl-22-oxa-8-silapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16,18,20-decaene 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

17,17-diphenyl-15,19-dioxa-17-silahexacyclo[16.7.0.02,7.08,16.09,14.020,25]pentacosa-1(18),2,4,6,8(16),9,11,13,20,22,24-undecaene
CID 140863388
11,11-diphenyl-3,19-dioxa-11-silapentacyclo[10.7.0.02,10.04,9.013,18]nonadeca-1(12),2(10),4,6,8,13,15,17-octaene
CID 132989883
1-(5,5-diphenylbenzo[b][1]benzosilol-1-yl)-3-phenyl-2-benzothiophene
CID 158775804
5-(2-methylphenyl)-5-phenylbenzo[b][1]benzosilole
CID 58711206
14-methyl-9,9-diphenyl-14-aza-9-silahexacyclo[11.11.0.02,10.03,8.015,24.018,23]tetracosa-1(13),2(10),3,5,7,11,15(24),16,18,20,22-undecaene
CID 140775274
17-methyl-14,14-diphenyl-10-oxa-14-silapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4,6,8,11,15(20),16,18-nonaene
CID 149181119
17-methyl-9,9-diphenyl-9-silapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16,18,20-decaene
CID 153488377
4,4,5,5-tetramethyl-2-(5-naphthalen-1-yl-5-phenylbenzo[b][1]benzosilol-1-yl)-1,3,2-dioxaborolane
CID 155787068
1-(2-phenyl-1-benzofuran-3-yl)-3-(2-phenylphenyl)-2-benzofuran
CID 156552693
bis(7,7-diphenylnaphtho[2,1-b][1]benzosilole);bis(21,21-diphenyl-21-silapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene);bis(spiro[benzo[b][1]benzosilole-5,7'-naphtho[2,1-b][1]benzosilole])
CID 157380469
11-(4,9,9-triphenyl-[1]benzosilolo[2,3-d]pyrimidin-2-yl)-[1]benzofuro[3,2-b]carbazole
CID 140804907
4-(3-dibenzofuran-2-yl-5-phenylphenyl)-6-[4-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)phenyl]-2-phenylpyrimidine
CID 171584528

Frequently Asked Questions

What is the IUPAC name of 8,8-diphenyl-22-oxa-8-silapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16,18,20-decaene?
The IUPAC name of 8,8-diphenyl-22-oxa-8-silapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16,18,20-decaene (CID 140863420) is 8,8-diphenyl-22-oxa-8-silapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16,18,20-decaene.
What is the SMILES notation for 8,8-diphenyl-22-oxa-8-silapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16,18,20-decaene?
The canonical SMILES for 8,8-diphenyl-22-oxa-8-silapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16,18,20-decaene is c1ccc([Si]2(c3ccccc3)c3ccccc3-c3oc4ccccc4c3-c3ccccc32)cc1.
What is the InChIKey of 8,8-diphenyl-22-oxa-8-silapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16,18,20-decaene?
The InChIKey is OWMRXLROGWTIHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H22OSi/c1-3-13-23(14-4-1)34(24-15-5-2-6-16-24)29-21-11-8-18-26(29)31-25-17-7-10-20-28(25)33-32(31)27-19-9-12-22-30(27)34/h1-22H.
What are the key properties of 8,8-diphenyl-22-oxa-8-silapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16,18,20-decaene?
8,8-diphenyl-22-oxa-8-silapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16,18,20-decaene has a molecular weight of 450.61 g/mol, XLogP of 5.46, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8-diphenyl-22-oxa-8-silapentacyclo[13.7.0.02,7.09,14.016,21]docosa-1(15),2,4,6,9,11,13,16,18,20-decaene is sourced from PubChem (CID 140863420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).