CID 23364708

C28H38FSi — CID 23364708

IUPAC—
SMILESCCC[Si]1CCC(C2CCC(CCc3ccc(-c4ccc(F)cc4)cc3)CC2)CC1
InChIInChI=1S/C28H38FSi/c1-2-19-30-20-17-27(18-21-30)25-11-7-23(8-12-25)4-3-22-5-9-24(10-6-22)26-13-15-28(29)16-14-26/h5-6,9-10,13-16,23,25,27H,2-4,7-8,11-12,17-21H2,1H3
InChIKeyBNIJIXXYETZXQO-UHFFFAOYSA-N
MW421.70 g/mol
LogP8.55
Rot. Bonds7

About CID 23364708

CID 23364708 (PubChem CID 23364708) has the molecular formula C28H38FSi and a molecular weight of 421.70 g/mol.

Molecular Properties

Compound NameCID 23364708
PubChem CID23364708
Molecular FormulaC28H38FSi
Molecular Weight421.70 g/mol
Exact Mass421.27
IUPAC Name—
SMILESCCC[Si]1CCC(C2CCC(CCc3ccc(-c4ccc(F)cc4)cc3)CC2)CC1
InChIInChI=1S/C28H38FSi/c1-2-19-30-20-17-27(18-21-30)25-11-7-23(8-12-25)4-3-22-5-9-24(10-6-22)26-13-15-28(29)16-14-26/h5-6,9-10,13-16,23,25,27H,2-4,7-8,11-12,17-21H2,1H3
InChIKeyBNIJIXXYETZXQO-UHFFFAOYSA-N
XLogP8.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.70
LogP ≤ 58.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

CID 23364777
CID 23364777
4-[4-[2-[4-(4-fluorophenyl)phenyl]ethyl]cyclohexyl]-1-propylsilinane
CID 54468401
CID 23364825
CID 23364825
CID 23364828
CID 23364828
1-[2-(4-cyclohexylcyclohexyl)ethyl]-4-fluorobenzene
CID 57067777
CID 19419990
CID 19419990
1-[2-[4-(4-butylcyclohexyl)cyclohexyl]ethyl]-4-[4-(fluoromethyl)phenyl]benzene
CID 21265275
CID 22913907
CID 22913907
1-fluoro-4-[2-[4-[(E)-2-[4-(4-methylcyclohexyl)cyclohexyl]ethenyl]cyclohexyl]ethyl]benzene
CID 19992676
1-methyl-4-[4-[2-[4-(4-methylcyclohexyl)cyclohexyl]ethyl]phenyl]benzene
CID 21136661
5-[4-[2-[4-(4-butylcyclohexyl)cyclohexyl]ethyl]phenyl]-1,3-difluoro-2-(fluoromethyl)benzene
CID 70820995
CID 23364743
CID 23364743

Frequently Asked Questions

What is the IUPAC name of CID 23364708?
The IUPAC name of CID 23364708 (CID 23364708) is not available.
What is the SMILES notation for CID 23364708?
The canonical SMILES for CID 23364708 is CCC[Si]1CCC(C2CCC(CCc3ccc(-c4ccc(F)cc4)cc3)CC2)CC1.
What is the InChIKey of CID 23364708?
The InChIKey is BNIJIXXYETZXQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H38FSi/c1-2-19-30-20-17-27(18-21-30)25-11-7-23(8-12-25)4-3-22-5-9-24(10-6-22)26-13-15-28(29)16-14-26/h5-6,9-10,13-16,23,25,27H,2-4,7-8,11-12,17-21H2,1H3.
What are the key properties of CID 23364708?
CID 23364708 has a molecular weight of 421.70 g/mol, XLogP of 8.55, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 23364708 is sourced from PubChem (CID 23364708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).