Cyclobutyldithymidine dimers
TL;DR: Cyclobutyldithymidine dimers (CAS 33407-74-8) is a chemical compound with molecular formula C20H28N4O10 and molecular weight 484.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2R,7R,8S)-3,12-bis[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-7,8-dimethyl-3,5,10,12-tetrazatricyclo[6.4.0.02,7]dodecane-4,6,9,11-tetrone
Also Known As: Cyclobutyldithymidine dimers, Cyclobutyl dithymidine dimers, Cyclobuta-dithymidine photoproducts, J2.081.041F, (1R,2S,7S,8R)-3,12-bis[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-7,8-dimethyl-3,5,10,12-tetrazatricyclo[6.4.0.02,7]dodecane-4,6,9,11-tetrone
| Molecular Formula | C20H28N4O10 |
|---|---|
| Molecular Weight | 484.18 g/mol |
| LogP | -2.5 |
| Topological Polar Surface Area | 198.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 484.18054 |
| Heavy Atoms | 34 |
| Complexity | 874.0 |
Chemical Identifiers
| CAS Number | 33407-74-8 |
|---|---|
| SMILES | C[C@@]12[C@@H]([C@H]3[C@@]1(C(=O)NC(=O)N3[C@H]4C[C@@H]([C@H](O4)CO)O)C)N(C(=O)NC2=O)[C@H]5C[C@@H]([C@H](O5)CO)O |
| InChIKey | YAHHPOUXPBUKTL-FVIZJAOPSA-N |
Product Overview
Cyclobutyldithymidine dimers (CAS 33407-74-8), with molecular formula C20H28N4O10 and molecular weight 484.18 g/mol. IUPAC: (1S,2R,7R,8S)-3,12-bis[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-7,8-dimethyl-3,5,10,12-tetrazatricyclo[6.4.0.02,7]dodecane-4,6,9,11-tetrone.
Chemical Property Profile of Cyclobutyldithymidine dimers
Property Insights of Cyclobutyldithymidine dimers
The XLogP value of -2.5 indicates that Cyclobutyldithymidine dimers is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 198.0 Ų indicates high polarity, suggesting Cyclobutyldithymidine dimers may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cyclobutyldithymidine dimers has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cyclobutyldithymidine dimers?
The CAS number of Cyclobutyldithymidine dimers is 33407-74-8.
What is the molecular formula of Cyclobutyldithymidine dimers?
The molecular formula of Cyclobutyldithymidine dimers is C20H28N4O10.
What is the molecular weight of Cyclobutyldithymidine dimers?
The molecular weight of Cyclobutyldithymidine dimers is 484.18 g/mol.
Where can I buy Cyclobutyldithymidine dimers?
You can request a quote for Cyclobutyldithymidine dimers directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclobutyldithymidine dimers?
Yes, KEHONG BIO provides custom synthesis services for Cyclobutyldithymidine dimers and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.