(2,4-dichlorophenyl)-(imidazol-1-ylmethyl)-dimethylsilane

C12H14Cl2N2Si — CID 13392416

IUPAC(2,4-dichlorophenyl)-(imidazol-1-ylmethyl)-dimethylsilane
SMILESC[Si](C)(Cn1ccnc1)c1ccc(Cl)cc1Cl
InChIInChI=1S/C12H14Cl2N2Si/c1-17(2,9-16-6-5-15-8-16)12-4-3-10(13)7-11(12)14/h3-8H,9H2,1-2H3
InChIKeySWTJWBFIVRJAKX-UHFFFAOYSA-N
MW285.25 g/mol
LogP3.34
Rot. Bonds3

About (2,4-dichlorophenyl)-(imidazol-1-ylmethyl)-dimethylsilane

(2,4-dichlorophenyl)-(imidazol-1-ylmethyl)-dimethylsilane (PubChem CID 13392416) has the molecular formula C12H14Cl2N2Si and a molecular weight of 285.25 g/mol. Its IUPAC name is (2,4-dichlorophenyl)-(imidazol-1-ylmethyl)-dimethylsilane.

Molecular Properties

Compound Name(2,4-dichlorophenyl)-(imidazol-1-ylmethyl)-dimethylsilane
PubChem CID13392416
Molecular FormulaC12H14Cl2N2Si
Molecular Weight285.25 g/mol
Exact Mass284.03
IUPAC Name(2,4-dichlorophenyl)-(imidazol-1-ylmethyl)-dimethylsilane
SMILESC[Si](C)(Cn1ccnc1)c1ccc(Cl)cc1Cl
InChIInChI=1S/C12H14Cl2N2Si/c1-17(2,9-16-6-5-15-8-16)12-4-3-10(13)7-11(12)14/h3-8H,9H2,1-2H3
InChIKeySWTJWBFIVRJAKX-UHFFFAOYSA-N
XLogP3.34
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.25
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

bis(2,4-dichlorophenyl)-(imidazol-1-ylmethyl)-methylsilane
CID 13392449
1-[[2-(2,4-dichlorophenyl)oxiran-2-yl]methyl]imidazole
CID 2783908
(1R)-1-(2,4-dichlorophenyl)-2-imidazol-1-ylethanol
CID 853401
2-(2,4-dichlorophenyl)-1-imidazol-1-yl-4-methylpentan-2-ol
CID 13058890
(4-bromophenyl)-(imidazol-1-ylmethyl)-dimethylsilane
CID 13392421
4-[(2,4-dichlorophenyl)methyl]-3-(imidazol-1-ylmethyl)-1H-1,2,4-triazol-5-one
CID 50952916
1-[2-(2,4-dichlorophenyl)-2-prop-1-enoxyethyl]imidazole
CID 54337740
2-(2,4-dichlorophenyl)-4-(imidazol-1-ylmethyl)-1,3-oxazole
CID 15925546
2-(2,4-dichlorophenyl)-1-imidazol-1-yl-3-morpholin-4-ylpropan-2-ol
CID 13189528
1-[2-(2,4-dichlorophenyl)-2-(2-methylprop-2-enoxy)ethyl]imidazole
CID 3009144
1-[(4-chloro-2-methoxyphenyl)methyl]imidazole
CID 69219836
1-(2,5-dichlorophenyl)-2-imidazol-1-ylethanol
CID 12760611

Frequently Asked Questions

What is the IUPAC name of (2,4-dichlorophenyl)-(imidazol-1-ylmethyl)-dimethylsilane?
The IUPAC name of (2,4-dichlorophenyl)-(imidazol-1-ylmethyl)-dimethylsilane (CID 13392416) is (2,4-dichlorophenyl)-(imidazol-1-ylmethyl)-dimethylsilane.
What is the SMILES notation for (2,4-dichlorophenyl)-(imidazol-1-ylmethyl)-dimethylsilane?
The canonical SMILES for (2,4-dichlorophenyl)-(imidazol-1-ylmethyl)-dimethylsilane is C[Si](C)(Cn1ccnc1)c1ccc(Cl)cc1Cl.
What is the InChIKey of (2,4-dichlorophenyl)-(imidazol-1-ylmethyl)-dimethylsilane?
The InChIKey is SWTJWBFIVRJAKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14Cl2N2Si/c1-17(2,9-16-6-5-15-8-16)12-4-3-10(13)7-11(12)14/h3-8H,9H2,1-2H3.
What are the key properties of (2,4-dichlorophenyl)-(imidazol-1-ylmethyl)-dimethylsilane?
(2,4-dichlorophenyl)-(imidazol-1-ylmethyl)-dimethylsilane has a molecular weight of 285.25 g/mol, XLogP of 3.34, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dichlorophenyl)-(imidazol-1-ylmethyl)-dimethylsilane is sourced from PubChem (CID 13392416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).