tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-4-(9H-carbazol-4-yloxy)butoxy]-diphenylsilane

C38H49NO3Si2 — CID 72711822

IUPACtert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-4-(9H-carbazol-4-yloxy)butoxy]-diphenylsilane
SMILESCC(C)(C)[Si](C)(C)OC(CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)COc1cccc2[nH]c3ccccc3c12
InChIInChI=1S/C38H49NO3Si2/c1-37(2,3)43(7,8)42-29(28-40-35-25-17-24-34-36(35)32-22-15-16-23-33(32)39-34)26-27-41-44(38(4,5)6,30-18-11-9-12-19-30)31-20-13-10-14-21-31/h9-25,29,39H,26-28H2,1-8H3
InChIKeyOYPYXXYBIIJPHR-UHFFFAOYSA-N
MW623.99 g/mol
LogP9.06
Rot. Bonds11

About tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-4-(9H-carbazol-4-yloxy)butoxy]-diphenylsilane

tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-4-(9H-carbazol-4-yloxy)butoxy]-diphenylsilane (PubChem CID 72711822) has the molecular formula C38H49NO3Si2 and a molecular weight of 623.99 g/mol. Its IUPAC name is tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-4-(9H-carbazol-4-yloxy)butoxy]-diphenylsilane.

Molecular Properties

Compound Nametert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-4-(9H-carbazol-4-yloxy)butoxy]-diphenylsilane
PubChem CID72711822
Molecular FormulaC38H49NO3Si2
Molecular Weight623.99 g/mol
Exact Mass623.33
IUPAC Nametert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-4-(9H-carbazol-4-yloxy)butoxy]-diphenylsilane
SMILESCC(C)(C)[Si](C)(C)OC(CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)COc1cccc2[nH]c3ccccc3c12
InChIInChI=1S/C38H49NO3Si2/c1-37(2,3)43(7,8)42-29(28-40-35-25-17-24-34-36(35)32-22-15-16-23-33(32)39-34)26-27-41-44(38(4,5)6,30-18-11-9-12-19-30)31-20-13-10-14-21-31/h9-25,29,39H,26-28H2,1-8H3
InChIKeyOYPYXXYBIIJPHR-UHFFFAOYSA-N
XLogP9.06
TPSA43.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500623.99
LogP ≤ 59.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-4-(9H-carbazol-4-yloxy)butoxy]-diphenylsilane 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

4-[tert-butyl(dimethyl)silyl]oxy-6-[tert-butyl(diphenyl)silyl]oxyhexanal
CID 11420340
7-[tert-butyl(dimethyl)silyl]oxy-9-[tert-butyl(diphenyl)silyl]oxy-4-triethylsilyloxynonanal
CID 11388220
tert-butyl-[1-[tert-butyl(dimethyl)silyl]oxyundecan-3-yloxy]-diphenylsilane
CID 156806459
1,3-bis(9H-carbazol-4-yloxy)propan-2-ol
CID 71314054
tert-butyl-[(3S)-1-[tert-butyl(dimethyl)silyl]oxyhept-5-en-3-yl]oxy-diphenylsilane
CID 91526312
tert-butyl-(3,3-dimethoxypropoxy)-diphenylsilane
CID 11142897
tert-butyl-[(3S)-5-[tert-butyl(dimethyl)silyl]oxypent-1-yn-3-yl]oxy-diphenylsilane
CID 155932039
tert-butyl-(2-iodoethoxy)-diphenylsilane
CID 11269862
tert-butyl-(3-fluoropent-4-ynoxy)-diphenylsilane
CID 122215628
N-[3-(9H-carbazol-4-yloxy)propyl]-1-fluoropropan-2-amine
CID 143717963
tert-butyl-[(E,3S)-1-[tert-butyl(dimethyl)silyl]oxy-5-iodohex-4-en-3-yl]oxy-diphenylsilane
CID 56931226
(3R,6R)-6-[1-amino-3-(9H-carbazol-4-yloxy)propan-2-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
CID 139025062

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-4-(9H-carbazol-4-yloxy)butoxy]-diphenylsilane?
The IUPAC name of tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-4-(9H-carbazol-4-yloxy)butoxy]-diphenylsilane (CID 72711822) is tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-4-(9H-carbazol-4-yloxy)butoxy]-diphenylsilane.
What is the SMILES notation for tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-4-(9H-carbazol-4-yloxy)butoxy]-diphenylsilane?
The canonical SMILES for tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-4-(9H-carbazol-4-yloxy)butoxy]-diphenylsilane is CC(C)(C)[Si](C)(C)OC(CCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)COc1cccc2[nH]c3ccccc3c12.
What is the InChIKey of tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-4-(9H-carbazol-4-yloxy)butoxy]-diphenylsilane?
The InChIKey is OYPYXXYBIIJPHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H49NO3Si2/c1-37(2,3)43(7,8)42-29(28-40-35-25-17-24-34-36(35)32-22-15-16-23-33(32)39-34)26-27-41-44(38(4,5)6,30-18-11-9-12-19-30)31-20-13-10-14-21-31/h9-25,29,39H,26-28H2,1-8H3.
What are the key properties of tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-4-(9H-carbazol-4-yloxy)butoxy]-diphenylsilane?
tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-4-(9H-carbazol-4-yloxy)butoxy]-diphenylsilane has a molecular weight of 623.99 g/mol, XLogP of 9.06, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[3-[tert-butyl(dimethyl)silyl]oxy-4-(9H-carbazol-4-yloxy)butoxy]-diphenylsilane is sourced from PubChem (CID 72711822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).