CID 173305494

C24H29SiTi — CID 173305494

IUPAC—
SMILESCC1=Cc2c(-c3ccccc3)cccc2C1[Si](C)C.CC=CC=CC.[Ti]
InChIInChI=1S/C18H19Si.C6H10.Ti/c1-13-12-17-15(14-8-5-4-6-9-14)10-7-11-16(17)18(13)19(2)3;1-3-5-6-4-2;/h4-12,18H,1-3H3;3-6H,1-2H3;
InChIKeyAFDFCBSGCYTOBN-UHFFFAOYSA-N
MW393.45 g/mol
LogP7.28
Rot. Bonds3

About CID 173305494

CID 173305494 (PubChem CID 173305494) has the molecular formula C24H29SiTi and a molecular weight of 393.45 g/mol.

Molecular Properties

Compound NameCID 173305494
PubChem CID173305494
Molecular FormulaC24H29SiTi
Molecular Weight393.45 g/mol
Exact Mass393.15
IUPAC Name—
SMILESCC1=Cc2c(-c3ccccc3)cccc2C1[Si](C)C.CC=CC=CC.[Ti]
InChIInChI=1S/C18H19Si.C6H10.Ti/c1-13-12-17-15(14-8-5-4-6-9-14)10-7-11-16(17)18(13)19(2)3;1-3-5-6-4-2;/h4-12,18H,1-3H3;3-6H,1-2H3;
InChIKeyAFDFCBSGCYTOBN-UHFFFAOYSA-N
XLogP7.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500393.45
LogP ≤ 57.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze CID 173305494 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

dimethyl-bis[(1R)-2-methyl-4-phenyl-1H-inden-1-yl]silane
CID 101111754
CID 174414122
CID 174414122
bis(tert-butylazanide);dimethyl-(2-methyl-4-phenyl-1H-inden-1-yl)silane;penta-1,3-diene;titanium(2+)
CID 157465323
CID 71082782
CID 71082782
CID 142753465
CID 142753465
N,N-diethyl-2-(2-methyl-4-phenyl-1H-inden-1-yl)aniline
CID 155667322
CID 69304218
CID 69304218
CID 91311200
CID 91311200
[methyl-[(2-methyl-4-phenyl-1H-inden-1-yl)methyl]silylidene]zirconium;bis(2-methyl-4-phenyl-1H-inden-1-ide);chloride
CID 172861665
(2-methyl-4-phenyl-1H-inden-1-yl)-diphenyl-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)silane
CID 139774717
4-(1,2-dimethyl-1H-inden-4-yl)-N,N-dimethylaniline
CID 143486580
CID 162724348
CID 162724348

Frequently Asked Questions

What is the IUPAC name of CID 173305494?
The IUPAC name of CID 173305494 (CID 173305494) is not available.
What is the SMILES notation for CID 173305494?
The canonical SMILES for CID 173305494 is CC1=Cc2c(-c3ccccc3)cccc2C1[Si](C)C.CC=CC=CC.[Ti].
What is the InChIKey of CID 173305494?
The InChIKey is AFDFCBSGCYTOBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19Si.C6H10.Ti/c1-13-12-17-15(14-8-5-4-6-9-14)10-7-11-16(17)18(13)19(2)3;1-3-5-6-4-2;/h4-12,18H,1-3H3;3-6H,1-2H3;.
What are the key properties of CID 173305494?
CID 173305494 has a molecular weight of 393.45 g/mol, XLogP of 7.28, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173305494 is sourced from PubChem (CID 173305494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).