5-羟甲基尿嘧啶
TL;DR: 5-羟甲基尿嘧啶 (CAS 4433-40-3) is a chemical compound with molecular formula C24H32N2O4S and molecular weight 444.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-羟甲基尿嘧啶
(3R,4R)-3,4-dihydroxyhexane-2,5-dione;N,N,2-trimethyl-3-phenothiazin-10-ylpropan-1-amine
Also Known As: Nedeltran, Panectyl, Repeltin, Therafene, Theralen
| Molecular Formula | C24H32N2O4S |
|---|---|
| Molecular Weight | 444.21 g/mol |
| LogP | 3.37 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 444.20828 |
| Heavy Atoms | 31 |
| Complexity | 445.0 |
Chemical Identifiers
| CAS Number | 4433-40-3 |
|---|---|
| SMILES | CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)CN(C)C.CC(=O)[C@@H]([C@H](C(=O)C)O)O |
| InChIKey | IGTHXMNRIKFVAW-LOLRQIBTSA-N |
Product Overview
5-羟甲基尿嘧啶 (CAS 4433-40-3), with molecular formula C24H32N2O4S and molecular weight 444.21 g/mol. IUPAC: (3R,4R)-3,4-dihydroxyhexane-2,5-dione;N,N,2-trimethyl-3-phenothiazin-10-ylpropan-1-amine.
Chemical Property Profile of 5-羟甲基尿嘧啶
Property Insights of 5-羟甲基尿嘧啶
The XLogP value of 3.37 indicates that 5-羟甲基尿嘧啶 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-羟甲基尿嘧啶. Following Lipinski's Rule of Five, 5-羟甲基尿嘧啶 has 2 hydrogen bond donor(s) and 7 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-羟甲基尿嘧啶?
The CAS number of 5-羟甲基尿嘧啶 is 4433-40-3.
What is the molecular formula of 5-羟甲基尿嘧啶?
The molecular formula of 5-羟甲基尿嘧啶 is C24H32N2O4S.
What is the molecular weight of 5-羟甲基尿嘧啶?
The molecular weight of 5-羟甲基尿嘧啶 is 444.21 g/mol.
Where can I buy 5-羟甲基尿嘧啶?
You can request a quote for 5-羟甲基尿嘧啶 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-羟甲基尿嘧啶?
Yes, KEHONG BIO provides custom synthesis services for 5-羟甲基尿嘧啶 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.