4-[4-(4-chloro-3-fluorophenyl)phenyl]-1-(4-propylcyclohexyl)silinane

C26H34ClFSi — CID 54729316

IUPAC4-[4-(4-chloro-3-fluorophenyl)phenyl]-1-(4-propylcyclohexyl)silinane
SMILESCCCC1CCC([SiH]2CCC(c3ccc(-c4ccc(Cl)c(F)c4)cc3)CC2)CC1
InChIInChI=1S/C26H34ClFSi/c1-2-3-19-4-11-24(12-5-19)29-16-14-22(15-17-29)20-6-8-21(9-7-20)23-10-13-25(27)26(28)18-23/h6-10,13,18-19,22,24,29H,2-5,11-12,14-17H2,1H3
InChIKeyANSDEHHKGOJHBV-UHFFFAOYSA-N
MW429.10 g/mol
LogP8.61
Rot. Bonds5

About 4-[4-(4-chloro-3-fluorophenyl)phenyl]-1-(4-propylcyclohexyl)silinane

4-[4-(4-chloro-3-fluorophenyl)phenyl]-1-(4-propylcyclohexyl)silinane (PubChem CID 54729316) has the molecular formula C26H34ClFSi and a molecular weight of 429.10 g/mol. Its IUPAC name is 4-[4-(4-chloro-3-fluorophenyl)phenyl]-1-(4-propylcyclohexyl)silinane.

Molecular Properties

Compound Name4-[4-(4-chloro-3-fluorophenyl)phenyl]-1-(4-propylcyclohexyl)silinane
PubChem CID54729316
Molecular FormulaC26H34ClFSi
Molecular Weight429.10 g/mol
Exact Mass428.21
IUPAC Name4-[4-(4-chloro-3-fluorophenyl)phenyl]-1-(4-propylcyclohexyl)silinane
SMILESCCCC1CCC([SiH]2CCC(c3ccc(-c4ccc(Cl)c(F)c4)cc3)CC2)CC1
InChIInChI=1S/C26H34ClFSi/c1-2-3-19-4-11-24(12-5-19)29-16-14-22(15-17-29)20-6-8-21(9-7-20)23-10-13-25(27)26(28)18-23/h6-10,13,18-19,22,24,29H,2-5,11-12,14-17H2,1H3
InChIKeyANSDEHHKGOJHBV-UHFFFAOYSA-N
XLogP8.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500429.10
LogP ≤ 58.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 4-[4-(4-chloro-3-fluorophenyl)phenyl]-1-(4-propylcyclohexyl)silinane 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

2-fluoro-4-[4-[1-(4-propylcyclohexyl)silinan-4-yl]phenyl]benzonitrile
CID 54734121
4-[4-(3,4-difluorophenyl)phenyl]-1-(4-pentylcyclohexyl)silinane
CID 54734843
1-chloro-4-[4-(4-propylcyclohexyl)phenyl]benzene
CID 118912523
1-chloro-2-fluoro-4-(4-fluorophenyl)benzene;1-(2-fluoroethyl)-4-(4-propylcyclohexyl)cyclohexane
CID 158500295
2-fluoro-4-(4-methylphenyl)-1-[4-(4-propylcyclohexyl)phenyl]benzene
CID 121399728
2-fluoro-4-[4-(4-methylcyclohexyl)phenyl]-1-(4-propylcyclohexyl)benzene
CID 54571988
1-fluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene
CID 611152
4-(4-chlorophenyl)-1-[4-(4,4-difluorobutyl)cyclohexyl]silinane
CID 70258911
2-fluoro-4-[4-[4-(fluoromethyl)cyclohexyl]phenyl]-1-(4-propylcyclohexyl)benzene
CID 21265243
2-fluoro-4-[4-(4-propylcyclohexyl)phenyl]phenol;octane
CID 144684748
1-chloro-4-[4-[2,2-difluoro-2-[4-(4-propylcyclohexyl)cyclohexyl]ethyl]phenyl]-2-fluorobenzene
CID 18344083
1,2-difluoro-4-[4-[(4R,6R)-2,2,6-trideuterio-4-propylcyclohexyl]phenyl]benzene
CID 54411513

Frequently Asked Questions

What is the IUPAC name of 4-[4-(4-chloro-3-fluorophenyl)phenyl]-1-(4-propylcyclohexyl)silinane?
The IUPAC name of 4-[4-(4-chloro-3-fluorophenyl)phenyl]-1-(4-propylcyclohexyl)silinane (CID 54729316) is 4-[4-(4-chloro-3-fluorophenyl)phenyl]-1-(4-propylcyclohexyl)silinane.
What is the SMILES notation for 4-[4-(4-chloro-3-fluorophenyl)phenyl]-1-(4-propylcyclohexyl)silinane?
The canonical SMILES for 4-[4-(4-chloro-3-fluorophenyl)phenyl]-1-(4-propylcyclohexyl)silinane is CCCC1CCC([SiH]2CCC(c3ccc(-c4ccc(Cl)c(F)c4)cc3)CC2)CC1.
What is the InChIKey of 4-[4-(4-chloro-3-fluorophenyl)phenyl]-1-(4-propylcyclohexyl)silinane?
The InChIKey is ANSDEHHKGOJHBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H34ClFSi/c1-2-3-19-4-11-24(12-5-19)29-16-14-22(15-17-29)20-6-8-21(9-7-20)23-10-13-25(27)26(28)18-23/h6-10,13,18-19,22,24,29H,2-5,11-12,14-17H2,1H3.
What are the key properties of 4-[4-(4-chloro-3-fluorophenyl)phenyl]-1-(4-propylcyclohexyl)silinane?
4-[4-(4-chloro-3-fluorophenyl)phenyl]-1-(4-propylcyclohexyl)silinane has a molecular weight of 429.10 g/mol, XLogP of 8.61, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(4-chloro-3-fluorophenyl)phenyl]-1-(4-propylcyclohexyl)silinane is sourced from PubChem (CID 54729316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).