5-propenyl-2'-deoxy-cytidine
TL;DR: 5-propenyl-2'-deoxy-cytidine (CAS 138750-04-6) is a chemical compound with molecular formula C12H17N3O4 and molecular weight 267.12192 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-prop-1-enylpyrimidin-2-one
Also Known As: 5-propenyl-2'-deoxy-cytidine
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H17N3O4 |
| Molecular Weight | 267.12192 g/mol |
| XLogP | -0.8 |
| Topological Polar Surface Area (TPSA) | 108.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.12192 Da |
| Heavy Atoms | 19 |
| Complexity | 458.0 |
| SMILES | CC=CC1=CN(C(=O)N=C1N)[C@H]2C[C@@H]([C@H](O2)CO)O |
| InChIKey | KATMTGGBSHKNTC-IVZWLZJFSA-N |
Chemical Property Profile of 5-propenyl-2'-deoxy-cytidine
Property Insights of 5-propenyl-2'-deoxy-cytidine
The XLogP value of -0.8 indicates that 5-propenyl-2'-deoxy-cytidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-propenyl-2'-deoxy-cytidine. Following Lipinski's Rule of Five, 5-propenyl-2'-deoxy-cytidine has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-propenyl-2'-deoxy-cytidine?
The CAS number of 5-propenyl-2'-deoxy-cytidine is 138750-04-6.
What is the molecular formula of 5-propenyl-2'-deoxy-cytidine?
The molecular formula of 5-propenyl-2'-deoxy-cytidine is C12H17N3O4.
What is the molecular weight of 5-propenyl-2'-deoxy-cytidine?
The molecular weight of 5-propenyl-2'-deoxy-cytidine is 267.12192 g/mol.
Where can I buy 5-propenyl-2'-deoxy-cytidine?
You can request a quote for 5-propenyl-2'-deoxy-cytidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-propenyl-2'-deoxy-cytidine?
Yes, CoreyChem provides custom synthesis services for 5-propenyl-2'-deoxy-cytidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.