Sulfapen
TL;DR: Sulfapen (CAS 130030-60-3) is a chemical compound with molecular formula C27H30N6O8S2 and molecular weight 630.1567 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-amino-N-(6-methoxypyridazin-3-yl)benzenesulfonamide;(2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2-phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Also Known As: Sulfapen, Tetrakis-trifluormethyl-mercapto-ethylen, Penicillin V mixture with Sulfamethoxypyridazine, (2S-(2alpha,5alpha,6beta))-3,3-Dimethyl-7-oxo-6-((phenoxyacetyl)amino)-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-Dimethyl-7-oxo-6-((phenoxyacetyl)amino)-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid (2S-(2alpha,5alpha,6beta))-, mixt. with 4-amino-N-(6-methoxy-3-pyridazinyl)benzenesulfonamide
Technical Specifications
| Molecular Formula | C27H30N6O8S2 |
| Molecular Weight | 630.1567 g/mol |
| XLogP | 1.5653 |
| Topological Polar Surface Area (TPSA) | 237.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 9 |
| Exact Mass | 630.1567 Da |
| Heavy Atoms | 43 |
| Complexity | 922.0 |
| SMILES | CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)COC3=CC=CC=C3)C(=O)O)C.COC1=NN=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)N |
| InChIKey | IVJAFAQQEPKQGJ-LQDWTQKMSA-N |
Chemical Property Profile of Sulfapen
Property Insights of Sulfapen
The XLogP value of 1.5653 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sulfapen. The TPSA of 237.0 Ų indicates high polarity, suggesting Sulfapen may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Sulfapen has 4 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Sulfapen?
The CAS number of Sulfapen is 130030-60-3.
What is the molecular formula of Sulfapen?
The molecular formula of Sulfapen is C27H30N6O8S2.
What is the molecular weight of Sulfapen?
The molecular weight of Sulfapen is 630.1567 g/mol.
Where can I buy Sulfapen?
You can request a quote for Sulfapen directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Sulfapen?
Yes, CoreyChem provides custom synthesis services for Sulfapen and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.