Cytosine deriv.
TL;DR: Cytosine deriv. (CAS 121055-65-0) is a chemical compound with molecular formula C24H42N4O5Si2 and molecular weight 522.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-[(2R,3R,4S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-cyanooxolan-2-yl]-2-oxopyrimidin-4-yl]acetamide
Also Known As: Cytosine deriv., N4-Acetyl-1-(2,5-bis-O-(t-butyldimethylsilyl)-3-C-cyano-3-deoxy-beta-D-xylopentofuranosyl)cytosine, Acetamide, N-(1-(3-cyano-3-deoxy-2,5-bis-O-((1,1-dimethylethyl)dimethylsilyl)-beta-D-xylofuranosyl)-1,2-dihydro-2-oxo-4-pyrimidinyl)-, 4-Acetamido-1-{2,5-bis-O-[tert-butyldi(methyl)silyl]-3-cyano-3-deoxy-beta-D-xylofuranosyl}pyrimidin-2(1H)-one, Acetamide, N-[1-[3-cyano-3-deoxy-2,5-bis-O-[(1,1-dimethylethyl)dimethylsilyl]-.beta.-D-xylofuranosyl]-1,2-dihydro-2-oxo-4-pyrimidinyl]-
| Molecular Formula | C24H42N4O5Si2 |
|---|---|
| Molecular Weight | 522.27 g/mol |
| LogP | 4.65108 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 522.26935 |
| Heavy Atoms | 35 |
| Complexity | 940.0 |
Chemical Identifiers
| CAS Number | 121055-65-0 |
|---|---|
| SMILES | CC(=O)NC1=NC(=O)N(C=C1)[C@H]2[C@@H]([C@H]([C@H](O2)CO[Si](C)(C)C(C)(C)C)C#N)O[Si](C)(C)C(C)(C)C |
| InChIKey | CWIYBDWSMFKVFG-UYWIDEMCSA-N |
Product Overview
Cytosine deriv. (CAS 121055-65-0), with molecular formula C24H42N4O5Si2 and molecular weight 522.27 g/mol. IUPAC: N-[1-[(2R,3R,4S,5S)-3-[tert-butyl(dimethyl)silyl]oxy-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-cyanooxolan-2-yl]-2-oxopyrimidin-4-yl]acetamide.
Chemical Property Profile of Cytosine deriv.
Property Insights of Cytosine deriv.
The XLogP value of 4.65108 indicates that Cytosine deriv. is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Cytosine deriv.. Following Lipinski's Rule of Five, Cytosine deriv. has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cytosine deriv.?
The CAS number of Cytosine deriv. is 121055-65-0.
What is the molecular formula of Cytosine deriv.?
The molecular formula of Cytosine deriv. is C24H42N4O5Si2.
What is the molecular weight of Cytosine deriv.?
The molecular weight of Cytosine deriv. is 522.27 g/mol.
Where can I buy Cytosine deriv.?
You can request a quote for Cytosine deriv. directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cytosine deriv.?
Yes, KEHONG BIO provides custom synthesis services for Cytosine deriv. and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.