4-(tert-Butyldimethylsilyloxymethyl)-5-(1,6-dihydroxyhexyl)-1,3-dibenzyl-2-imidazolidinone Benzyl Ether - CAS 1796891-25-2
Catalog: |
BB071747 |
Product Name: |
4-(tert-Butyldimethylsilyloxymethyl)-5-(1,6-dihydroxyhexyl)-1,3-dibenzyl-2-imidazolidinone Benzyl Ether |
CAS: |
1796891-25-2 |
Synonyms: |
1,3-Dibenzyl-4-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(1-hydroxy-6-phenylmethoxyhexyl)imidazolidin-2-one; 4-(tert-Butyldimethylsilyloxymethyl)-5-(1,6-dihydroxyhexyl)-1,3-dibenzyl-2-imidazolidinone Benzyl Et; 4-(tert-Butyldimethylsilyloxymethyl)-5-(1,6-dihydroxyhexyl)-1,3-dibenzyl-2-imidazolidinone Benzyl Ether |
IUPAC Name: | 1,3-dibenzyl-4-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-(1-hydroxy-6-phenylmethoxyhexyl)imidazolidin-2-one |
Description: | Used in the preparation of Selenobiotin (S248000). |
Molecular Weight: | 616.91 |
Molecular Formula: | C37H52N2O4Si |
Canonical SMILES: | CC(C)(C)[Si](C)(C)OCC1C(N(C(=O)N1CC2=CC=CC=C2)CC3=CC=CC=C3)C(CCCCCOCC4=CC=CC=C4)O |
InChI: | InChI=1S/C37H52N2O4Si/c1-37(2,3)44(4,5)43-29-33-35(34(40)24-16-9-17-25-42-28-32-22-14-8-15-23-32)39(27-31-20-12-7-13-21-31)36(41)38(33)26-30-18-10-6-11-19-30/h6-8,10-15,18-23,33-35,40H,9,16-17,24-29H2,1-5H3 |
InChI Key: | WAZIOJYYGXJHLC-UHFFFAOYSA-N |
Solubility: | Dichloromethane |
Appearance: | Clear Oil |
Complexity: | 830 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 616.36963468 |
Formal Charge: | 0 |
Heavy Atom Count: | 44 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 616.36963468 |
Rotatable Bond Count: | 17 |
Topological Polar Surface Area: | 62.2Ų |
Undefined Atom Stereocenter Count: | 3 |
Undefined Bond Stereocenter Count: | 0 |
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