Dihydrocodeine bitartrate, aspirin and caffeine
TL;DR: Dihydrocodeine bitartrate, aspirin and caffeine (CAS 79102-58-2) is a chemical compound with molecular formula C44H52ClN7O8S and molecular weight 873.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetyloxybenzoic acid;N,N-dimethyl-1-phenothiazin-10-ylpropan-2-amine;N-(4-ethoxyphenyl)acetamide;1,3,7-trimethylpurine-2,6-dione;hydrochloride
Also Known As: Synalgos, Dihydrocodeine bitartrate, aspirin and caffeine, Aspirin mixture with caffeine, phenacetin and promethazine, 2-acetyloxybenzoic acid;N,N-dimethyl-1-phenothiazin-10-ylpropan-2-amine;N-(4-ethoxyphenyl)acetamide;1,3,7-trimethylpurine-2,6-dione;hydrochloride, 2-acetyloxybenzoic acid; N,N-dimethyl-1-phenothiazin-10-ylpropan-2-amine; N-(4-ethoxyphenyl)acetamide; 1,3,7-trimethylpurine-2,6-dione; hydrochloride
| Molecular Formula | C44H52ClN7O8S |
|---|---|
| Molecular Weight | 873.33 g/mol |
| LogP | 6.9857 |
| Topological Polar Surface Area | 192.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 9 |
| Exact Mass | 873.3287 |
| Heavy Atoms | 61 |
| Complexity | 965.0 |
Chemical Identifiers
| CAS Number | 79102-58-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)C.CC(CN1C2=CC=CC=C2SC3=CC=CC=C31)N(C)C.CC(=O)OC1=CC=CC=C1C(=O)O.CN1C=NC2=C1C(=O)N(C(=O)N2C)C.Cl |
| InChIKey | ZGWVKGYYNSULOV-UHFFFAOYSA-N |
Product Overview
Dihydrocodeine bitartrate, aspirin and caffeine (CAS 79102-58-2), with molecular formula C44H52ClN7O8S and molecular weight 873.33 g/mol. IUPAC: 2-acetyloxybenzoic acid;N,N-dimethyl-1-phenothiazin-10-ylpropan-2-amine;N-(4-ethoxyphenyl)acetamide;1,3,7-trimethylpurine-2,6-dione;hydrochloride.
Chemical Property Profile of Dihydrocodeine bitartrate, aspirin and caffeine
Property Insights of Dihydrocodeine bitartrate, aspirin and caffeine
The XLogP value of 6.9857 indicates that Dihydrocodeine bitartrate, aspirin and caffeine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 192.0 Ų indicates high polarity, suggesting Dihydrocodeine bitartrate, aspirin and caffeine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dihydrocodeine bitartrate, aspirin and caffeine has 3 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dihydrocodeine bitartrate, aspirin and caffeine?
The CAS number of Dihydrocodeine bitartrate, aspirin and caffeine is 79102-58-2.
What is the molecular formula of Dihydrocodeine bitartrate, aspirin and caffeine?
The molecular formula of Dihydrocodeine bitartrate, aspirin and caffeine is C44H52ClN7O8S.
What is the molecular weight of Dihydrocodeine bitartrate, aspirin and caffeine?
The molecular weight of Dihydrocodeine bitartrate, aspirin and caffeine is 873.33 g/mol.
Where can I buy Dihydrocodeine bitartrate, aspirin and caffeine?
You can request a quote for Dihydrocodeine bitartrate, aspirin and caffeine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydrocodeine bitartrate, aspirin and caffeine?
Yes, KEHONG BIO provides custom synthesis services for Dihydrocodeine bitartrate, aspirin and caffeine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.