CID 177302488

C26H56N2O8Si4 — CID 177302488

IUPAC—
SMILESCOC(OC)[Si]CN1CC(CCCCCCC(C)C2CN(C[Si]C(OC)OC)C[Si](C)(OC)O2)O[Si](C)(OC)C1
InChIInChI=1S/C26H56N2O8Si4/c1-22(24-17-28(19-38-26(31-4)32-5)21-40(9,34-7)36-24)14-12-10-11-13-15-23-16-27(18-37-25(29-2)30-3)20-39(8,33-6)35-23/h22-26H,10-21H2,1-9H3
InChIKeyOZVTYMTXIPRGEJ-UHFFFAOYSA-N
MW637.08 g/mol
LogP2.36
Rot. Bonds20

About CID 177302488

CID 177302488 (PubChem CID 177302488) has the molecular formula C26H56N2O8Si4 and a molecular weight of 637.08 g/mol.

Molecular Properties

Compound NameCID 177302488
PubChem CID177302488
Molecular FormulaC26H56N2O8Si4
Molecular Weight637.08 g/mol
Exact Mass636.31
IUPAC Name—
SMILESCOC(OC)[Si]CN1CC(CCCCCCC(C)C2CN(C[Si]C(OC)OC)C[Si](C)(OC)O2)O[Si](C)(OC)C1
InChIInChI=1S/C26H56N2O8Si4/c1-22(24-17-28(19-38-26(31-4)32-5)21-40(9,34-7)36-24)14-12-10-11-13-15-23-16-27(18-37-25(29-2)30-3)20-39(8,33-6)35-23/h22-26H,10-21H2,1-9H3
InChIKeyOZVTYMTXIPRGEJ-UHFFFAOYSA-N
XLogP2.36
TPSA80.32 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds20
Heavy Atoms40
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500637.08
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze CID 177302488 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

CID 177302475
CID 177302475
2-(6,6-dimethoxyhexyl)oxirane
CID 22101928
trimethoxy-[4-[1-methoxy-7-methyl-10-(4-trimethoxysilylbutyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecan-3-yl]butyl]silane
CID 18730823
1-[(2-methoxy-2-methyl-1,6,2-dioxasilocan-8-yl)methyl]piperidine
CID 67462069
2-[11-[12-(oxetan-2-yl)dodecan-2-yloxy]dodecyl]oxetane
CID 66633104
(2R,6S)-2-butyl-4-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-6-propan-2-ylmorpholine
CID 155509779
7-(oxiran-2-yl)octanoic acid
CID 90805841
2-[7-(1,3-dioxolan-2-yl)heptan-2-yl]-1,3-dioxolane
CID 101148003
3,7-bis(1,4-dioxan-2-yl)octan-1-ol
CID 174444862
tris(1-methoxyethoxy)-[4-(oxiran-2-yl)butyl]silane
CID 18508396
2-(6-bromo-7-methyloctyl)oxolane
CID 65165254
2-(5-methylhexyl)oxetane
CID 173452744

Frequently Asked Questions

What is the IUPAC name of CID 177302488?
The IUPAC name of CID 177302488 (CID 177302488) is not available.
What is the SMILES notation for CID 177302488?
The canonical SMILES for CID 177302488 is COC(OC)[Si]CN1CC(CCCCCCC(C)C2CN(C[Si]C(OC)OC)C[Si](C)(OC)O2)O[Si](C)(OC)C1.
What is the InChIKey of CID 177302488?
The InChIKey is OZVTYMTXIPRGEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H56N2O8Si4/c1-22(24-17-28(19-38-26(31-4)32-5)21-40(9,34-7)36-24)14-12-10-11-13-15-23-16-27(18-37-25(29-2)30-3)20-39(8,33-6)35-23/h22-26H,10-21H2,1-9H3.
What are the key properties of CID 177302488?
CID 177302488 has a molecular weight of 637.08 g/mol, XLogP of 2.36, 20 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for CID 177302488 is sourced from PubChem (CID 177302488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).