硫酸甲氧苄啶
TL;DR: 硫酸甲氧苄啶 (CAS 56585-33-2) is a chemical compound with molecular formula C28H38N8O10S and molecular weight 678.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硫酸甲氧苄啶
sulfuric acid;bis(5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-diamine)
Also Known As: Trimethoprim sulfate, Polytrim, Trimethoprim sulphate, Trimethoprim-sulfate, BW 72U
| Molecular Formula | C28H38N8O10S |
|---|---|
| Molecular Weight | 678.24 g/mol |
| LogP | 1.86 |
| Topological Polar Surface Area | 294.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 10 |
| Exact Mass | 678.24316 |
| Heavy Atoms | 47 |
| Complexity | 388.0 |
Chemical Identifiers
| CAS Number | 56585-33-2 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)CC2=CN=C(N=C2N)N.COC1=CC(=CC(=C1OC)OC)CC2=CN=C(N=C2N)N.OS(=O)(=O)O |
| InChIKey | UILMMYFRNCCPLK-UHFFFAOYSA-N |
Product Overview
硫酸甲氧苄啶 (CAS 56585-33-2), with molecular formula C28H38N8O10S and molecular weight 678.24 g/mol. IUPAC: sulfuric acid;bis(5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-diamine).
Chemical Property Profile of 硫酸甲氧苄啶
Property Insights of 硫酸甲氧苄啶
The XLogP value of 1.86 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 硫酸甲氧苄啶. The TPSA of 294.0 Ų indicates high polarity, suggesting 硫酸甲氧苄啶 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 硫酸甲氧苄啶 has 6 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 硫酸甲氧苄啶?
The CAS number of 硫酸甲氧苄啶 is 56585-33-2.
What is the molecular formula of 硫酸甲氧苄啶?
The molecular formula of 硫酸甲氧苄啶 is C28H38N8O10S.
What is the molecular weight of 硫酸甲氧苄啶?
The molecular weight of 硫酸甲氧苄啶 is 678.24 g/mol.
Where can I buy 硫酸甲氧苄啶?
You can request a quote for 硫酸甲氧苄啶 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硫酸甲氧苄啶?
Yes, KEHONG BIO provides custom synthesis services for 硫酸甲氧苄啶 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.