BAS 08330576
TL;DR: BAS 08330576 (CAS 1214675-03-2) is a chemical compound with molecular formula C17H16N2O4S and molecular weight 344.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethenyl-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Also Known As: BAS 08330576, 3-ethenyl-8-oxo-7-[(phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 8-Oxo-7-phenylacetylamino-3-vinyl-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-ethenyl-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-ethenyl-8-oxidanylidene-7-(2-phenylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
| Molecular Formula | C17H16N2O4S |
|---|---|
| Molecular Weight | 344.08 g/mol |
| LogP | 1.1537 |
| Topological Polar Surface Area | 86.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 344.08307 |
| Heavy Atoms | 24 |
| Complexity | 744.2172 |
Chemical Identifiers
| CAS Number | 1214675-03-2 |
|---|---|
| SMILES | C=CC1=C(N2C(C(C2=O)NC(=O)CC3=CC=CC=C3)SC1)C(=O)O |
Product Overview
BAS 08330576 (CAS 1214675-03-2), with molecular formula C17H16N2O4S and molecular weight 344.08 g/mol. IUPAC: 3-ethenyl-8-oxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid.
Chemical Property Profile of BAS 08330576
Property Insights of BAS 08330576
The XLogP value of 1.1537 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 08330576. The TPSA of 86.71 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 08330576. Following Lipinski's Rule of Five, BAS 08330576 has 2 hydrogen bond donor(s) and 4 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 BAS 08330576?
The CAS number of BAS 08330576 is 1214675-03-2.
What is the molecular formula of BAS 08330576?
The molecular formula of BAS 08330576 is C17H16N2O4S.
What is the molecular weight of BAS 08330576?
The molecular weight of BAS 08330576 is 344.08 g/mol.
Where can I buy BAS 08330576?
You can request a quote for BAS 08330576 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 08330576?
Yes, KEHONG BIO provides custom synthesis services for BAS 08330576 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.