(2R,3S,5R,6S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5,6-dimethoxyoxan-3-ol

C24H34O5Si — CID 18646869

IUPAC(2R,3S,5R,6S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5,6-dimethoxyoxan-3-ol
SMILESCO[C@H]1O[C@H](CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)[C@@H](O)C[C@H]1OC
InChIInChI=1S/C24H34O5Si/c1-24(2,3)30(18-12-8-6-9-13-18,19-14-10-7-11-15-19)28-17-22-20(25)16-21(26-4)23(27-5)29-22/h6-15,20-23,25H,16-17H2,1-5H3/t20-,21+,22+,23-/m0/s1
InChIKeyXFLCYQZZQKKNMR-AFXVXQJMSA-N
MW430.62 g/mol
LogP2.70
Rot. Bonds7

About (2R,3S,5R,6S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5,6-dimethoxyoxan-3-ol

(2R,3S,5R,6S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5,6-dimethoxyoxan-3-ol (PubChem CID 18646869) has the molecular formula C24H34O5Si and a molecular weight of 430.62 g/mol. Its IUPAC name is (2R,3S,5R,6S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5,6-dimethoxyoxan-3-ol.

Molecular Properties

Compound Name(2R,3S,5R,6S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5,6-dimethoxyoxan-3-ol
PubChem CID18646869
Molecular FormulaC24H34O5Si
Molecular Weight430.62 g/mol
Exact Mass430.22
IUPAC Name(2R,3S,5R,6S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5,6-dimethoxyoxan-3-ol
SMILESCO[C@H]1O[C@H](CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)[C@@H](O)C[C@H]1OC
InChIInChI=1S/C24H34O5Si/c1-24(2,3)30(18-12-8-6-9-13-18,19-14-10-7-11-15-19)28-17-22-20(25)16-21(26-4)23(27-5)29-22/h6-15,20-23,25H,16-17H2,1-5H3/t20-,21+,22+,23-/m0/s1
InChIKeyXFLCYQZZQKKNMR-AFXVXQJMSA-N
XLogP2.70
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.62
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze (2R,3S,5R,6S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5,6-dimethoxyoxan-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R,3S,5R,6S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5,6-dimethoxyoxan-3-ol?
The IUPAC name of (2R,3S,5R,6S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5,6-dimethoxyoxan-3-ol (CID 18646869) is (2R,3S,5R,6S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5,6-dimethoxyoxan-3-ol.
What is the SMILES notation for (2R,3S,5R,6S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5,6-dimethoxyoxan-3-ol?
The canonical SMILES for (2R,3S,5R,6S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5,6-dimethoxyoxan-3-ol is CO[C@H]1O[C@H](CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)[C@@H](O)C[C@H]1OC.
What is the InChIKey of (2R,3S,5R,6S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5,6-dimethoxyoxan-3-ol?
The InChIKey is XFLCYQZZQKKNMR-AFXVXQJMSA-N. The full InChI is InChI=1S/C24H34O5Si/c1-24(2,3)30(18-12-8-6-9-13-18,19-14-10-7-11-15-19)28-17-22-20(25)16-21(26-4)23(27-5)29-22/h6-15,20-23,25H,16-17H2,1-5H3/t20-,21+,22+,23-/m0/s1.
What are the key properties of (2R,3S,5R,6S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5,6-dimethoxyoxan-3-ol?
(2R,3S,5R,6S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5,6-dimethoxyoxan-3-ol has a molecular weight of 430.62 g/mol, XLogP of 2.70, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S,5R,6S)-2-[[tert-butyl(diphenyl)silyl]oxymethyl]-5,6-dimethoxyoxan-3-ol is sourced from PubChem (CID 18646869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).