5'-Thymidylic acid, 3'-(azidomethyl)-3'-deoxy-
TL;DR: 5'-Thymidylic acid, 3'-(azidomethyl)-3'-deoxy- (CAS 445249-36-5) is a chemical compound with molecular formula C11H16N5O7P and molecular weight 361.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,3R,5R)-3-(azidomethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl dihydrogen phosphate
Also Known As: 5'-Thymidylic acid, 3'-(azidomethyl)-3'-deoxy-, [(2S,3R,5R)-3-(azidomethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl dihydrogen phosphate
| Molecular Formula | C11H16N5O7P |
|---|---|
| Molecular Weight | 361.08 g/mol |
| LogP | 0.16832 |
| Topological Polar Surface Area | 179.61 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 361.07874 |
| Heavy Atoms | 24 |
| Complexity | 807.71594 |
Chemical Identifiers
| CAS Number | 445249-36-5 |
|---|---|
| SMILES | CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)(O)O)CN=[N+]=[N-] |
Product Overview
5'-Thymidylic acid, 3'-(azidomethyl)-3'-deoxy- (CAS 445249-36-5), with molecular formula C11H16N5O7P and molecular weight 361.08 g/mol. IUPAC: [(2S,3R,5R)-3-(azidomethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl dihydrogen phosphate.
Chemical Property Profile of 5'-Thymidylic acid, 3'-(azidomethyl)-3'-deoxy-
Property Insights of 5'-Thymidylic acid, 3'-(azidomethyl)-3'-deoxy-
The XLogP value of 0.16832 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5'-Thymidylic acid, 3'-(azidomethyl)-3'-deoxy-. The TPSA of 179.61 Ų indicates high polarity, suggesting 5'-Thymidylic acid, 3'-(azidomethyl)-3'-deoxy- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5'-Thymidylic acid, 3'-(azidomethyl)-3'-deoxy- has 3 hydrogen bond donor(s) and 6 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'-Thymidylic acid, 3'-(azidomethyl)-3'-deoxy-?
The CAS number of 5'-Thymidylic acid, 3'-(azidomethyl)-3'-deoxy- is 445249-36-5.
What is the molecular formula of 5'-Thymidylic acid, 3'-(azidomethyl)-3'-deoxy-?
The molecular formula of 5'-Thymidylic acid, 3'-(azidomethyl)-3'-deoxy- is C11H16N5O7P.
What is the molecular weight of 5'-Thymidylic acid, 3'-(azidomethyl)-3'-deoxy-?
The molecular weight of 5'-Thymidylic acid, 3'-(azidomethyl)-3'-deoxy- is 361.08 g/mol.
Where can I buy 5'-Thymidylic acid, 3'-(azidomethyl)-3'-deoxy-?
You can request a quote for 5'-Thymidylic acid, 3'-(azidomethyl)-3'-deoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5'-Thymidylic acid, 3'-(azidomethyl)-3'-deoxy-?
Yes, KEHONG BIO provides custom synthesis services for 5'-Thymidylic acid, 3'-(azidomethyl)-3'-deoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.