5-methoxymethyl-N(4)-methyl-2'-deoxycytidine
TL;DR: 5-methoxymethyl-N(4)-methyl-2'-deoxycytidine (CAS 15657-96-2) is a chemical compound with molecular formula C12H19N3O5 and molecular weight 285.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(methoxymethyl)-4-(methylamino)pyrimidin-2-one
Also Known As: 5-Mmmdc, 2'-deoxy-5-(methoxymethyl)-n-methylcytidine, 5-Methoxymethyl-N(4)-methyl-2'-deoxycytidine, 5-Methoxymethyl-N-methyl-2 -deoxycytidine, Cytidine, 2'-deoxy-5-(methoxymethyl)-N-methyl-
| Molecular Formula | C12H19N3O5 |
|---|---|
| Molecular Weight | 285.13 g/mol |
| LogP | -1.7 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 285.13248 |
| Heavy Atoms | 20 |
| Complexity | 437.0 |
Chemical Identifiers
| CAS Number | 15657-96-2 |
|---|---|
| SMILES | CNC1=NC(=O)N(C=C1COC)[C@H]2C[C@@H]([C@H](O2)CO)O |
| InChIKey | CZRYOFPBYHGRBK-IVZWLZJFSA-N |
Product Overview
5-methoxymethyl-N(4)-methyl-2'-deoxycytidine (CAS 15657-96-2), with molecular formula C12H19N3O5 and molecular weight 285.13 g/mol. IUPAC: 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(methoxymethyl)-4-(methylamino)pyrimidin-2-one.
Chemical Property Profile of 5-methoxymethyl-N(4)-methyl-2'-deoxycytidine
Property Insights of 5-methoxymethyl-N(4)-methyl-2'-deoxycytidine
The XLogP value of -1.7 indicates that 5-methoxymethyl-N(4)-methyl-2'-deoxycytidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-methoxymethyl-N(4)-methyl-2'-deoxycytidine. Following Lipinski's Rule of Five, 5-methoxymethyl-N(4)-methyl-2'-deoxycytidine has 3 hydrogen bond donor(s) and 5 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-methoxymethyl-N(4)-methyl-2'-deoxycytidine?
The CAS number of 5-methoxymethyl-N(4)-methyl-2'-deoxycytidine is 15657-96-2.
What is the molecular formula of 5-methoxymethyl-N(4)-methyl-2'-deoxycytidine?
The molecular formula of 5-methoxymethyl-N(4)-methyl-2'-deoxycytidine is C12H19N3O5.
What is the molecular weight of 5-methoxymethyl-N(4)-methyl-2'-deoxycytidine?
The molecular weight of 5-methoxymethyl-N(4)-methyl-2'-deoxycytidine is 285.13 g/mol.
Where can I buy 5-methoxymethyl-N(4)-methyl-2'-deoxycytidine?
You can request a quote for 5-methoxymethyl-N(4)-methyl-2'-deoxycytidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-methoxymethyl-N(4)-methyl-2'-deoxycytidine?
Yes, KEHONG BIO provides custom synthesis services for 5-methoxymethyl-N(4)-methyl-2'-deoxycytidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.