diphenyl-(9-phenylcarbazol-3-yl)-(thian-4-yl)silane;(1-methylazepin-3-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;(1-methylazepin-4-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-2-yl-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-3-yl-diphenyl-(9-phenylcarbazol-3-yl)silane

C181H145N7O2SSi5 — CID 158013832

IUPACdiphenyl-(9-phenylcarbazol-3-yl)-(thian-4-yl)silane;(1-methylazepin-3-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;(1-methylazepin-4-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-2-yl-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-3-yl-diphenyl-(9-phenylcarbazol-3-yl)silane
SMILESC1=CC=C([Si](c2ccccc2)(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)OC=C1.C1=COC=C([Si](c2ccccc2)(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)C=C1.CN1C=CC=C([Si](c2ccccc2)(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)C=C1.CN1C=CC=CC([Si](c2ccccc2)(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)=C1.c1ccc(-n2c3ccccc3c3cc([Si](c4ccccc4)(c4ccccc4)C4CCSCC4)ccc32)cc1
InChIInChI=1S/2C37H30N2Si.2C36H27NOSi.C35H31NSSi/c1-38-26-14-13-21-33(28-38)40(30-17-7-3-8-18-30,31-19-9-4-10-20-31)32-24-25-37-35(27-32)34-22-11-12-23-36(34)39(37)29-15-5-2-6-16-29;1-38-26-13-20-32(25-27-38)40(30-16-7-3-8-17-30,31-18-9-4-10-19-31)33-23-24-37-35(28-33)34-21-11-12-22-36(34)39(37)29-14-5-2-6-15-29;1-5-15-28(16-6-1)37-34-22-13-12-21-32(34)33-27-31(24-25-35(33)37)39(29-17-7-2-8-18-29,30-19-9-3-10-20-30)36-23-11-4-14-26-38-36;1-4-14-28(15-5-1)37-35-22-11-10-21-33(35)34-26-31(23-24-36(34)37)39(29-16-6-2-7-17-29,30-18-8-3-9-19-30)32-20-12-13-25-38-27-32;1-4-12-27(13-5-1)36-34-19-11-10-18-32(34)33-26-31(20-21-35(33)36)38(28-14-6-2-7-15-28,29-16-8-3-9-17-29)30-22-24-37-25-23-30/h2*2-28H,1H3;2*1-27H;1-21,26,30H,22-25H2
InChIKeyFFFJYVPTTDIMOP-UHFFFAOYSA-N
MW2622.69 g/mol
LogP34.09
Rot. Bonds25

About diphenyl-(9-phenylcarbazol-3-yl)-(thian-4-yl)silane;(1-methylazepin-3-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;(1-methylazepin-4-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-2-yl-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-3-yl-diphenyl-(9-phenylcarbazol-3-yl)silane

diphenyl-(9-phenylcarbazol-3-yl)-(thian-4-yl)silane;(1-methylazepin-3-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;(1-methylazepin-4-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-2-yl-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-3-yl-diphenyl-(9-phenylcarbazol-3-yl)silane (PubChem CID 158013832) has the molecular formula C181H145N7O2SSi5 and a molecular weight of 2622.69 g/mol. Its IUPAC name is diphenyl-(9-phenylcarbazol-3-yl)-(thian-4-yl)silane;(1-methylazepin-3-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;(1-methylazepin-4-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-2-yl-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-3-yl-diphenyl-(9-phenylcarbazol-3-yl)silane.

Molecular Properties

Compound Namediphenyl-(9-phenylcarbazol-3-yl)-(thian-4-yl)silane;(1-methylazepin-3-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;(1-methylazepin-4-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-2-yl-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-3-yl-diphenyl-(9-phenylcarbazol-3-yl)silane
PubChem CID158013832
Molecular FormulaC181H145N7O2SSi5
Molecular Weight2622.69 g/mol
Exact Mass2620.00
IUPAC Namediphenyl-(9-phenylcarbazol-3-yl)-(thian-4-yl)silane;(1-methylazepin-3-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;(1-methylazepin-4-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-2-yl-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-3-yl-diphenyl-(9-phenylcarbazol-3-yl)silane
SMILESC1=CC=C([Si](c2ccccc2)(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)OC=C1.C1=COC=C([Si](c2ccccc2)(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)C=C1.CN1C=CC=C([Si](c2ccccc2)(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)C=C1.CN1C=CC=CC([Si](c2ccccc2)(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)=C1.c1ccc(-n2c3ccccc3c3cc([Si](c4ccccc4)(c4ccccc4)C4CCSCC4)ccc32)cc1
InChIInChI=1S/2C37H30N2Si.2C36H27NOSi.C35H31NSSi/c1-38-26-14-13-21-33(28-38)40(30-17-7-3-8-18-30,31-19-9-4-10-20-31)32-24-25-37-35(27-32)34-22-11-12-23-36(34)39(37)29-15-5-2-6-16-29;1-38-26-13-20-32(25-27-38)40(30-16-7-3-8-17-30,31-18-9-4-10-19-31)33-23-24-37-35(28-33)34-21-11-12-22-36(34)39(37)29-14-5-2-6-15-29;1-5-15-28(16-6-1)37-34-22-13-12-21-32(34)33-27-31(24-25-35(33)37)39(29-17-7-2-8-18-29,30-19-9-3-10-20-30)36-23-11-4-14-26-38-36;1-4-14-28(15-5-1)37-35-22-11-10-21-33(35)34-26-31(23-24-36(34)37)39(29-16-6-2-7-17-29,30-18-8-3-9-19-30)32-20-12-13-25-38-27-32;1-4-12-27(13-5-1)36-34-19-11-10-18-32(34)33-26-31(20-21-35(33)36)38(28-14-6-2-7-15-28,29-16-8-3-9-17-29)30-22-24-37-25-23-30/h2*2-28H,1H3;2*1-27H;1-21,26,30H,22-25H2
InChIKeyFFFJYVPTTDIMOP-UHFFFAOYSA-N
XLogP34.09
TPSA49.59 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds25
Heavy Atoms196
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002622.69
LogP ≤ 534.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

Analyze diphenyl-(9-phenylcarbazol-3-yl)-(thian-4-yl)silane;(1-methylazepin-3-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;(1-methylazepin-4-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-2-yl-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-3-yl-diphenyl-(9-phenylcarbazol-3-yl)silane 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

diphenyl-(9-phenylcarbazol-3-yl)-(thian-4-yl)silane
CID 158013835
cyclohexyl-diphenyl-(9-phenylcarbazol-3-yl)silane
CID 158356675
diphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane
CID 89393751
bis(11,12-diphenylindolo[2,3-a]carbazol-3-yl)-diphenylsilane
CID 58489663
(4-methylphenyl)-diphenyl-(9-phenylcarbazol-3-yl)silane
CID 158052706
[3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-triphenylsilane;[3-(3-carbazol-9-yl-6-trimethylsilylcarbazol-9-yl)phenyl]-triphenylsilane;[3-(3-carbazol-9-yl-6-triphenylsilylcarbazol-9-yl)phenyl]-triphenylsilane
CID 165013153
[9-(4-methylphenyl)carbazol-3-yl]-triphenylsilane
CID 168811108
triphenyl-[9-phenyl-6-[9-[4-(3-phenylphenyl)phenyl]carbazol-3-yl]carbazol-3-yl]silane
CID 140790437
[4-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-triphenylsilane
CID 159773868
CID 161109385
CID 161109385
N-[4-(9-phenylcarbazol-3-yl)phenyl]-4-(4-trimethylsilylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline
CID 90195243
[7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane
CID 170516315

Frequently Asked Questions

What is the IUPAC name of diphenyl-(9-phenylcarbazol-3-yl)-(thian-4-yl)silane;(1-methylazepin-3-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;(1-methylazepin-4-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-2-yl-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-3-yl-diphenyl-(9-phenylcarbazol-3-yl)silane?
The IUPAC name of diphenyl-(9-phenylcarbazol-3-yl)-(thian-4-yl)silane;(1-methylazepin-3-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;(1-methylazepin-4-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-2-yl-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-3-yl-diphenyl-(9-phenylcarbazol-3-yl)silane (CID 158013832) is diphenyl-(9-phenylcarbazol-3-yl)-(thian-4-yl)silane;(1-methylazepin-3-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;(1-methylazepin-4-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-2-yl-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-3-yl-diphenyl-(9-phenylcarbazol-3-yl)silane.
What is the SMILES notation for diphenyl-(9-phenylcarbazol-3-yl)-(thian-4-yl)silane;(1-methylazepin-3-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;(1-methylazepin-4-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-2-yl-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-3-yl-diphenyl-(9-phenylcarbazol-3-yl)silane?
The canonical SMILES for diphenyl-(9-phenylcarbazol-3-yl)-(thian-4-yl)silane;(1-methylazepin-3-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;(1-methylazepin-4-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-2-yl-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-3-yl-diphenyl-(9-phenylcarbazol-3-yl)silane is C1=CC=C([Si](c2ccccc2)(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)OC=C1.C1=COC=C([Si](c2ccccc2)(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)C=C1.CN1C=CC=C([Si](c2ccccc2)(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)C=C1.CN1C=CC=CC([Si](c2ccccc2)(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)=C1.c1ccc(-n2c3ccccc3c3cc([Si](c4ccccc4)(c4ccccc4)C4CCSCC4)ccc32)cc1.
What is the InChIKey of diphenyl-(9-phenylcarbazol-3-yl)-(thian-4-yl)silane;(1-methylazepin-3-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;(1-methylazepin-4-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-2-yl-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-3-yl-diphenyl-(9-phenylcarbazol-3-yl)silane?
The InChIKey is FFFJYVPTTDIMOP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C37H30N2Si.2C36H27NOSi.C35H31NSSi/c1-38-26-14-13-21-33(28-38)40(30-17-7-3-8-18-30,31-19-9-4-10-20-31)32-24-25-37-35(27-32)34-22-11-12-23-36(34)39(37)29-15-5-2-6-16-29;1-38-26-13-20-32(25-27-38)40(30-16-7-3-8-17-30,31-18-9-4-10-19-31)33-23-24-37-35(28-33)34-21-11-12-22-36(34)39(37)29-14-5-2-6-15-29;1-5-15-28(16-6-1)37-34-22-13-12-21-32(34)33-27-31(24-25-35(33)37)39(29-17-7-2-8-18-29,30-19-9-3-10-20-30)36-23-11-4-14-26-38-36;1-4-14-28(15-5-1)37-35-22-11-10-21-33(35)34-26-31(23-24-36(34)37)39(29-16-6-2-7-17-29,30-18-8-3-9-19-30)32-20-12-13-25-38-27-32;1-4-12-27(13-5-1)36-34-19-11-10-18-32(34)33-26-31(20-21-35(33)36)38(28-14-6-2-7-15-28,29-16-8-3-9-17-29)30-22-24-37-25-23-30/h2*2-28H,1H3;2*1-27H;1-21,26,30H,22-25H2.
What are the key properties of diphenyl-(9-phenylcarbazol-3-yl)-(thian-4-yl)silane;(1-methylazepin-3-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;(1-methylazepin-4-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-2-yl-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-3-yl-diphenyl-(9-phenylcarbazol-3-yl)silane?
diphenyl-(9-phenylcarbazol-3-yl)-(thian-4-yl)silane;(1-methylazepin-3-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;(1-methylazepin-4-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-2-yl-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-3-yl-diphenyl-(9-phenylcarbazol-3-yl)silane has a molecular weight of 2622.69 g/mol, XLogP of 34.09, 25 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-(9-phenylcarbazol-3-yl)-(thian-4-yl)silane;(1-methylazepin-3-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;(1-methylazepin-4-yl)-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-2-yl-diphenyl-(9-phenylcarbazol-3-yl)silane;oxepin-3-yl-diphenyl-(9-phenylcarbazol-3-yl)silane is sourced from PubChem (CID 158013832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).