N(4)-benzoyl-2',3'-dideoxy-2',3'-didehydrocytidine
TL;DR: N(4)-benzoyl-2',3'-dideoxy-2',3'-didehydrocytidine (CAS 123413-57-0) is a chemical compound with molecular formula C16H15N3O4 and molecular weight 313.10626 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[1-[(2R,5S)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-2-oxopyrimidin-4-yl]benzamide
Also Known As: Bz-Ddcn, N(4)-Benzoyl-2',3'-dideoxy-2',3'-didehydrocytidine, N-Benzoyl-2',3'-didehydro-2',3'-dideoxycytidine, Cytidine, N-benzoyl-2',3'-didehydro-2',3'-dideoxy-, n-{1-[(2r,5s)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]-2-oxo-1,2-dihydropyrimidin-4-yl}benzamide
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H15N3O4 |
| Molecular Weight | 313.10626 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 91.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 313.10626 Da |
| Heavy Atoms | 23 |
| Complexity | 564.0 |
| SMILES | C1=CC=C(C=C1)C(=O)NC2=NC(=O)N(C=C2)[C@H]3C=C[C@H](O3)CO |
| InChIKey | PXKQTZQZCJHBQL-GXTWGEPZSA-N |
Chemical Property Profile of N(4)-benzoyl-2',3'-dideoxy-2',3'-didehydrocytidine
Property Insights of N(4)-benzoyl-2',3'-dideoxy-2',3'-didehydrocytidine
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N(4)-benzoyl-2',3'-dideoxy-2',3'-didehydrocytidine. The TPSA of 91.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N(4)-benzoyl-2',3'-dideoxy-2',3'-didehydrocytidine. Following Lipinski's Rule of Five, N(4)-benzoyl-2',3'-dideoxy-2',3'-didehydrocytidine has 2 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 N(4)-benzoyl-2',3'-dideoxy-2',3'-didehydrocytidine?
The CAS number of N(4)-benzoyl-2',3'-dideoxy-2',3'-didehydrocytidine is 123413-57-0.
What is the molecular formula of N(4)-benzoyl-2',3'-dideoxy-2',3'-didehydrocytidine?
The molecular formula of N(4)-benzoyl-2',3'-dideoxy-2',3'-didehydrocytidine is C16H15N3O4.
What is the molecular weight of N(4)-benzoyl-2',3'-dideoxy-2',3'-didehydrocytidine?
The molecular weight of N(4)-benzoyl-2',3'-dideoxy-2',3'-didehydrocytidine is 313.10626 g/mol.
Where can I buy N(4)-benzoyl-2',3'-dideoxy-2',3'-didehydrocytidine?
You can request a quote for N(4)-benzoyl-2',3'-dideoxy-2',3'-didehydrocytidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N(4)-benzoyl-2',3'-dideoxy-2',3'-didehydrocytidine?
Yes, CoreyChem provides custom synthesis services for N(4)-benzoyl-2',3'-dideoxy-2',3'-didehydrocytidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.