EINECS 260-677-5
TL;DR: EINECS 260-677-5 (CAS 57320-90-8) is a chemical compound with molecular formula C16H16N2O5S and molecular weight 348.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6R,7R)-7-[acetyl(phenoxy)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: EINECS 260-677-5, (6R-trans)-7-(Acetylphenoxyamino)-3-methyl-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, (6R,7R)-3-METHYL-8-OXO-7-(N-PHENOXYACETAMIDO)-5-THIA-1-AZABICYCLO[4.2.0]OCT-2-ENE-2-CARBOXYLIC ACID, (6R,7R)-7-[acetyl(phenoxy)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R)-7alpha-(Acetylphenoxyamino)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
| Molecular Formula | C16H16N2O5S |
|---|---|
| Molecular Weight | 348.08 g/mol |
| LogP | 1.4712 |
| Topological Polar Surface Area | 87.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 348.078 |
| Heavy Atoms | 24 |
| Complexity | 733.24316 |
Chemical Identifiers
| CAS Number | 57320-90-8 |
|---|---|
| SMILES | CC1=C(N2[C@@H]([C@@H](C2=O)N(C(=O)C)OC3=CC=CC=C3)SC1)C(=O)O |
Product Overview
EINECS 260-677-5 (CAS 57320-90-8), with molecular formula C16H16N2O5S and molecular weight 348.08 g/mol. IUPAC: (6R,7R)-7-[acetyl(phenoxy)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid.
Chemical Property Profile of EINECS 260-677-5
Property Insights of EINECS 260-677-5
The XLogP value of 1.4712 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 260-677-5. The TPSA of 87.15 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 260-677-5. Following Lipinski's Rule of Five, EINECS 260-677-5 has 1 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 EINECS 260-677-5?
The CAS number of EINECS 260-677-5 is 57320-90-8.
What is the molecular formula of EINECS 260-677-5?
The molecular formula of EINECS 260-677-5 is C16H16N2O5S.
What is the molecular weight of EINECS 260-677-5?
The molecular weight of EINECS 260-677-5 is 348.08 g/mol.
Where can I buy EINECS 260-677-5?
You can request a quote for EINECS 260-677-5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 260-677-5?
Yes, KEHONG BIO provides custom synthesis services for EINECS 260-677-5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.