hippuryl-L-phenylacetate
TL;DR: hippuryl-L-phenylacetate (CAS 86944-29-8) is a chemical compound with molecular formula C18H17NO5 and molecular weight 327.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl (2S)-2-(2-benzamidoacetyl)oxypropanoate
Also Known As: Hippuryl-L-phenylacetate, phenyl(2s)-2-[(n-benzoylglycyl)oxy]propanoate, phenyl (2S)-2-(2-benzamidoacetyl)oxypropanoate, Propanoic acid, 2-(((benzoylamino)acetyl)oxy)-, phenyl ester, (S)-, N-(2-Oxo-2-{[(2S)-1-oxo-1-phenoxypropan-2-yl]oxy}ethyl)benzenecarboximidic acid
| Molecular Formula | C18H17NO5 |
|---|---|
| Molecular Weight | 327.11 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 327.1107 |
| Heavy Atoms | 24 |
| Complexity | 439.0 |
Chemical Identifiers
| CAS Number | 86944-29-8 |
|---|---|
| SMILES | C[C@@H](C(=O)OC1=CC=CC=C1)OC(=O)CNC(=O)C2=CC=CC=C2 |
| InChIKey | CRPJCHOPDZJPIE-ZDUSSCGKSA-N |
Product Overview
hippuryl-L-phenylacetate (CAS 86944-29-8), with molecular formula C18H17NO5 and molecular weight 327.11 g/mol. IUPAC: phenyl (2S)-2-(2-benzamidoacetyl)oxypropanoate.
Chemical Property Profile of hippuryl-L-phenylacetate
Property Insights of hippuryl-L-phenylacetate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for hippuryl-L-phenylacetate. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for hippuryl-L-phenylacetate. Following Lipinski's Rule of Five, hippuryl-L-phenylacetate 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 hippuryl-L-phenylacetate?
The CAS number of hippuryl-L-phenylacetate is 86944-29-8.
What is the molecular formula of hippuryl-L-phenylacetate?
The molecular formula of hippuryl-L-phenylacetate is C18H17NO5.
What is the molecular weight of hippuryl-L-phenylacetate?
The molecular weight of hippuryl-L-phenylacetate is 327.11 g/mol.
Where can I buy hippuryl-L-phenylacetate?
You can request a quote for hippuryl-L-phenylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for hippuryl-L-phenylacetate?
Yes, KEHONG BIO provides custom synthesis services for hippuryl-L-phenylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.