3DiMeAllyl-2',5'diSilylSpiroT
TL;DR: 3DiMeAllyl-2',5'diSilylSpiroT (CAS 142102-82-7) is a chemical compound with molecular formula C29H51N3O8SSi2 and molecular weight 657.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(6R,8R,9R)-4-amino-9-[tert-butyl(dimethyl)silyl]oxy-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,2-dioxo-1,7-dioxa-2λ6-thiaspiro[4.4]non-3-en-8-yl]-5-methyl-3-(3-methylbut-2-enyl)pyrimidine-2,4-dione
Also Known As: TSAO analog, 3DiMeAllyl-2',5'diSilylSpiroT, (1-(2',5'-Bis-O-(tert-butyldimethylsilyl)-beta-D-ribofuranosyl)-3-N-(3-methyl-2-butenyl)thymine)-3'-spiro-5-(4-amino-1,2-oxathiole-2,2-dioxide), [1-[2',5'-Bis-O-(tert-butyldimethylsilyl)-.beta.-D-ribofuranosyl]-3-N-(3-methyl-2-butenyl)thymine]-3'-spiro-5-(4-amino-1,2-oxathiole-2,2-dioxide), 1-[(1R,3R,4R)-6-amino-4-[tert-butyl(dimethyl)silyl]oxy-1-[[tert-butyl(dimethyl)silyl]oxymethyl]-8,8-dioxo-2,9-dioxa-8
| Molecular Formula | C29H51N3O8SSi2 |
|---|---|
| Molecular Weight | 657.29 g/mol |
| LogP | 4.49312 |
| Topological Polar Surface Area | 146.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 657.2935 |
| Heavy Atoms | 43 |
| Complexity | 1330.0 |
Chemical Identifiers
| CAS Number | 142102-82-7 |
|---|---|
| SMILES | CC1=CN(C(=O)N(C1=O)CC=C(C)C)[C@H]2[C@@H](C3([C@H](O2)CO[Si](C)(C)C(C)(C)C)C(=CS(=O)(=O)O3)N)O[Si](C)(C)C(C)(C)C |
| InChIKey | CLRYOESCHWZLHF-LHTBOPMYSA-N |
Product Overview
3DiMeAllyl-2',5'diSilylSpiroT (CAS 142102-82-7), with molecular formula C29H51N3O8SSi2 and molecular weight 657.29 g/mol. IUPAC: 1-[(6R,8R,9R)-4-amino-9-[tert-butyl(dimethyl)silyl]oxy-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,2-dioxo-1,7-dioxa-2λ6-thiaspiro[4.4]non-3-en-8-yl]-5-methyl-3-(3-methylbut-2-enyl)pyrimidine-2,4-dione.
Chemical Property Profile of 3DiMeAllyl-2',5'diSilylSpiroT
Property Insights of 3DiMeAllyl-2',5'diSilylSpiroT
The XLogP value of 4.49312 indicates that 3DiMeAllyl-2',5'diSilylSpiroT is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 146.0 Ų indicates high polarity, suggesting 3DiMeAllyl-2',5'diSilylSpiroT may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3DiMeAllyl-2',5'diSilylSpiroT has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3DiMeAllyl-2',5'diSilylSpiroT?
The CAS number of 3DiMeAllyl-2',5'diSilylSpiroT is 142102-82-7.
What is the molecular formula of 3DiMeAllyl-2',5'diSilylSpiroT?
The molecular formula of 3DiMeAllyl-2',5'diSilylSpiroT is C29H51N3O8SSi2.
What is the molecular weight of 3DiMeAllyl-2',5'diSilylSpiroT?
The molecular weight of 3DiMeAllyl-2',5'diSilylSpiroT is 657.29 g/mol.
Where can I buy 3DiMeAllyl-2',5'diSilylSpiroT?
You can request a quote for 3DiMeAllyl-2',5'diSilylSpiroT directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3DiMeAllyl-2',5'diSilylSpiroT?
Yes, KEHONG BIO provides custom synthesis services for 3DiMeAllyl-2',5'diSilylSpiroT and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.