SK&F 80000
TL;DR: SK&F 80000 (CAS 61606-60-8) is a chemical compound with molecular formula C18H17N7O5S2 and molecular weight 475.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6R,7R)-7-[[(2E)-2-hydroxyimino-2-phenylacetyl]amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: Skf 80000, SK&F 80000, SK&F-80000, (6R,7R)-7-[[(2E)-2-hydroxyimino-2-phenylacetyl]amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((hydroxyimino)phenylacetyl)amino)-3-(((1-methyl-1H-tetrazol-5-yl)thio)methyl)-8-oxo-, (6R-(6alpha,7beta(Z)))-
| Molecular Formula | C18H17N7O5S2 |
|---|---|
| Molecular Weight | 475.07 g/mol |
| LogP | -0.0807 |
| Topological Polar Surface Area | 162.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 475.07327 |
| Heavy Atoms | 32 |
| Complexity | 1133.7482 |
Chemical Identifiers
| CAS Number | 61606-60-8 |
|---|---|
| SMILES | CN1C(=NN=N1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)/C(=N/O)/C4=CC=CC=C4)SC2)C(=O)O |
Product Overview
SK&F 80000 (CAS 61606-60-8), with molecular formula C18H17N7O5S2 and molecular weight 475.07 g/mol. IUPAC: (6R,7R)-7-[[(2E)-2-hydroxyimino-2-phenylacetyl]amino]-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid.
Chemical Property Profile of SK&F 80000
Property Insights of SK&F 80000
The XLogP value of -0.0807 indicates that SK&F 80000 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 162.9 Ų indicates high polarity, suggesting SK&F 80000 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, SK&F 80000 has 3 hydrogen bond donor(s) and 10 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 SK&F 80000?
The CAS number of SK&F 80000 is 61606-60-8.
What is the molecular formula of SK&F 80000?
The molecular formula of SK&F 80000 is C18H17N7O5S2.
What is the molecular weight of SK&F 80000?
The molecular weight of SK&F 80000 is 475.07 g/mol.
Where can I buy SK&F 80000?
You can request a quote for SK&F 80000 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SK&F 80000?
Yes, KEHONG BIO provides custom synthesis services for SK&F 80000 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.