![7-氨基-3-甲基-8-氧代-5-硫杂-1-氮杂双环[4.2.0]辛-2-烯-2-甲酸 structure](/static/products/2225/22252-43-3.webp)
7-氨基-3-甲基-8-氧代-5-硫杂-1-氮杂双环[4.2.0]辛-2-烯-2-甲酸
TL;DR: 7-氨基-3-甲基-8-氧代-5-硫杂-1-氮杂双环[4.2.0]辛-2-烯-2-甲酸 (CAS 22252-43-3) is a chemical compound with molecular formula C8H10N2O3S and molecular weight 214.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-氨基-3-甲基-8-氧代-5-硫杂-1-氮杂双环[4.2.0]辛-2-烯-2-甲酸
(6R,7R)-7-amino-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: 7-ADCA, 7-aminodesacetoxycephalosporanic acid, 7-aminodeacetoxycephalosporanic acid, Cephalexin Impurity B, (6R,7R)-7-amino-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
| Molecular Formula | C8H10N2O3S |
|---|---|
| Molecular Weight | 214.04 g/mol |
| LogP | -3.1 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 214.04121 |
| Heavy Atoms | 14 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 22252-43-3 |
|---|---|
| SMILES | CC1=C(N2[C@@H]([C@@H](C2=O)N)SC1)C(=O)O |
| InChIKey | NVIAYEIXYQCDAN-CLZZGJSISA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-氨基-3-甲基-8-氧代-5-硫杂-1-氮杂双环[4.2.0]辛-2-烯-2-甲酸 (CAS 22252-43-3), with molecular formula C8H10N2O3S and molecular weight 214.04 g/mol. IUPAC: (6R,7R)-7-amino-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid.
Chemical Property Profile of 7-氨基-3-甲基-8-氧代-5-硫杂-1-氮杂双环[4.2.0]辛-2-烯-2-甲酸
Property Insights of 7-氨基-3-甲基-8-氧代-5-硫杂-1-氮杂双环[4.2.0]辛-2-烯-2-甲酸
The XLogP value of -3.1 indicates that 7-氨基-3-甲基-8-氧代-5-硫杂-1-氮杂双环[4.2.0]辛-2-烯-2-甲酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-氨基-3-甲基-8-氧代-5-硫杂-1-氮杂双环[4.2.0]辛-2-烯-2-甲酸. Following Lipinski's Rule of Five, 7-氨基脱乙酰氧基头孢烷酸 has 2 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 7-氨基脱乙酰氧基头孢烷酸?
The CAS number of 7-氨基脱乙酰氧基头孢烷酸 is 22252-43-3.
What is the molecular formula of 7-氨基脱乙酰氧基头孢烷酸?
The molecular formula of 7-氨基脱乙酰氧基头孢烷酸 is C8H10N2O3S.
What is the molecular weight of 7-氨基脱乙酰氧基头孢烷酸?
The molecular weight of 7-氨基脱乙酰氧基头孢烷酸 is 214.04 g/mol.
Where can I buy 7-氨基脱乙酰氧基头孢烷酸?
You can request a quote for 7-氨基脱乙酰氧基头孢烷酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-氨基脱乙酰氧基头孢烷酸?
Yes, KEHONG BIO provides custom synthesis services for 7-氨基脱乙酰氧基头孢烷酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.