1-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)thymine
TL;DR: 1-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)thymine (CAS 133488-39-8) is a chemical compound with molecular formula C11H17N3O5 and molecular weight 271.11682 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2R,4S)-4-amino-5-[(1S)-1,2-dihydroxyethyl]oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Also Known As: 3NH-D-ribo-ddT deriv., 1-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)thymine, 2,4(1H,3H)-Pyrimidinedione, 1-(3-amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)-5-methyl-, 1-(3-Amino-2,3-dideoxy-.beta.-D-ribo-hexofuranosyl)thymine, 1-[(2R,4S)-4-amino-5-[(1S)-1,2-dihydroxyethyl]oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Technical Specifications
| Molecular Formula | C11H17N3O5 |
| Molecular Weight | 271.11682 g/mol |
| XLogP | -1.6 |
| Topological Polar Surface Area (TPSA) | 125.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.11682 Da |
| Heavy Atoms | 19 |
| Complexity | 425.0 |
| SMILES | CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H](C(O2)[C@H](CO)O)N |
| InChIKey | JQTHJBSNTDLZGU-VTBDLZGYSA-N |
Chemical Property Profile of 1-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)thymine
Property Insights of 1-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)thymine
The XLogP value of -1.6 indicates that 1-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)thymine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)thymine. Following Lipinski's Rule of Five, 1-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)thymine has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)thymine?
The CAS number of 1-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)thymine is 133488-39-8.
What is the molecular formula of 1-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)thymine?
The molecular formula of 1-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)thymine is C11H17N3O5.
What is the molecular weight of 1-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)thymine?
The molecular weight of 1-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)thymine is 271.11682 g/mol.
Where can I buy 1-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)thymine?
You can request a quote for 1-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)thymine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)thymine?
Yes, CoreyChem provides custom synthesis services for 1-(3-Amino-2,3-dideoxy-beta-D-ribo-hexofuranosyl)thymine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.