7beta-Phenylacetylaminocepham-3-one-4xi-carboxylic acid diphenylmethyl ester
TL;DR: 7beta-Phenylacetylaminocepham-3-one-4xi-carboxylic acid diphenylmethyl ester (CAS 54639-48-4) is a chemical compound with molecular formula C28H24N2O5S and molecular weight 500.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzhydryl (6R,7R)-3,8-dioxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate
Also Known As: 7beta-phenylacetylaminocepham-3-one-4xi-carboxylic acid diphenylmethyl ester, 7beta-phenylacetylamino-cepham-3-one-4xi-carboxylic acid diphenylmethyl ester, diphenylmethyl (6R,7R)-3,8-dioxo-7-(2-phenylacetamido)-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate
| Molecular Formula | C28H24N2O5S |
|---|---|
| Molecular Weight | 500.14 g/mol |
| LogP | 2.8995 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 500.1406 |
| Heavy Atoms | 36 |
| Complexity | 1229.3721 |
Chemical Identifiers
| CAS Number | 54639-48-4 |
|---|---|
| SMILES | C1C(=O)C(N2[C@H](S1)[C@@H](C2=O)NC(=O)CC3=CC=CC=C3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5 |
Product Overview
7beta-Phenylacetylaminocepham-3-one-4xi-carboxylic acid diphenylmethyl ester (CAS 54639-48-4), with molecular formula C28H24N2O5S and molecular weight 500.14 g/mol. IUPAC: benzhydryl (6R,7R)-3,8-dioxo-7-[(2-phenylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate.
Chemical Property Profile of 7beta-Phenylacetylaminocepham-3-one-4xi-carboxylic acid diphenylmethyl ester
Property Insights of 7beta-Phenylacetylaminocepham-3-one-4xi-carboxylic acid diphenylmethyl ester
The XLogP value of 2.8995 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7beta-Phenylacetylaminocepham-3-one-4xi-carboxylic acid diphenylmethyl ester. The TPSA of 92.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 7beta-Phenylacetylaminocepham-3-one-4xi-carboxylic acid diphenylmethyl ester. Following Lipinski's Rule of Five, 7beta-Phenylacetylaminocepham-3-one-4xi-carboxylic acid diphenylmethyl ester has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7beta-Phenylacetylaminocepham-3-one-4xi-carboxylic acid diphenylmethyl ester?
The CAS number of 7beta-Phenylacetylaminocepham-3-one-4xi-carboxylic acid diphenylmethyl ester is 54639-48-4.
What is the molecular formula of 7beta-Phenylacetylaminocepham-3-one-4xi-carboxylic acid diphenylmethyl ester?
The molecular formula of 7beta-Phenylacetylaminocepham-3-one-4xi-carboxylic acid diphenylmethyl ester is C28H24N2O5S.
What is the molecular weight of 7beta-Phenylacetylaminocepham-3-one-4xi-carboxylic acid diphenylmethyl ester?
The molecular weight of 7beta-Phenylacetylaminocepham-3-one-4xi-carboxylic acid diphenylmethyl ester is 500.14 g/mol.
Where can I buy 7beta-Phenylacetylaminocepham-3-one-4xi-carboxylic acid diphenylmethyl ester?
You can request a quote for 7beta-Phenylacetylaminocepham-3-one-4xi-carboxylic acid diphenylmethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7beta-Phenylacetylaminocepham-3-one-4xi-carboxylic acid diphenylmethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 7beta-Phenylacetylaminocepham-3-one-4xi-carboxylic acid diphenylmethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.