5'-deoxy-5'-<4-(fluorosulfonyl)benzamido>thymidine
TL;DR: 5'-deoxy-5'-<4-(fluorosulfonyl)benzamido>thymidine (CAS 101314-81-2) is a chemical compound with molecular formula C17H18FN3O7S and molecular weight 427.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methylcarbamoyl]benzenesulfonyl fluoride
Also Known As: 5'-deoxy-5'-<4-(fluorosulfonyl)benzamido>thymidine, 4-[[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methylcarbamoyl]benzenesulfonyl fluoride, 4-{[(2R,3S,5R)-3-Hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-tetrahydro-furan-2-ylmethyl]-carbamoyl}-benzenesulfonyl fluoride
| Molecular Formula | C17H18FN3O7S |
|---|---|
| Molecular Weight | 427.08 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 150.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 427.08496 |
| Heavy Atoms | 29 |
| Complexity | 817.0 |
Chemical Identifiers
| CAS Number | 101314-81-2 |
|---|---|
| SMILES | CC1=CN(C(=O)NC1=O)C2CC(C(O2)CNC(=O)C3=CC=C(C=C3)S(=O)(=O)F)O |
| InChIKey | MVIBENONYJYITO-UHFFFAOYSA-N |
Product Overview
5'-deoxy-5'-<4-(fluorosulfonyl)benzamido>thymidine (CAS 101314-81-2), with molecular formula C17H18FN3O7S and molecular weight 427.08 g/mol. IUPAC: 4-[[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methylcarbamoyl]benzenesulfonyl fluoride.
Chemical Property Profile of 5'-deoxy-5'-<4-(fluorosulfonyl)benzamido>thymidine
Property Insights of 5'-deoxy-5'-<4-(fluorosulfonyl)benzamido>thymidine
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5'-deoxy-5'-<4-(fluorosulfonyl)benzamido>thymidine. The TPSA of 150.0 Ų indicates high polarity, suggesting 5'-deoxy-5'-<4-(fluorosulfonyl)benzamido>thymidine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5'-deoxy-5'-<4-(fluorosulfonyl)benzamido>thymidine has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5'-deoxy-5'-<4-(fluorosulfonyl)benzamido>thymidine?
The CAS number of 5'-deoxy-5'-<4-(fluorosulfonyl)benzamido>thymidine is 101314-81-2.
What is the molecular formula of 5'-deoxy-5'-<4-(fluorosulfonyl)benzamido>thymidine?
The molecular formula of 5'-deoxy-5'-<4-(fluorosulfonyl)benzamido>thymidine is C17H18FN3O7S.
What is the molecular weight of 5'-deoxy-5'-<4-(fluorosulfonyl)benzamido>thymidine?
The molecular weight of 5'-deoxy-5'-<4-(fluorosulfonyl)benzamido>thymidine is 427.08 g/mol.
Where can I buy 5'-deoxy-5'-<4-(fluorosulfonyl)benzamido>thymidine?
You can request a quote for 5'-deoxy-5'-<4-(fluorosulfonyl)benzamido>thymidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5'-deoxy-5'-<4-(fluorosulfonyl)benzamido>thymidine?
Yes, KEHONG BIO provides custom synthesis services for 5'-deoxy-5'-<4-(fluorosulfonyl)benzamido>thymidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.