(S)-8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate
TL;DR: (S)-8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate (CAS 956044-73-8) is a chemical compound with molecular formula C31H25NO7 and molecular weight 523.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8-methoxy-6-oxobenzo[c]chromen-3-yl) (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate
Also Known As: (S)-8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate, (8-methoxy-6-oxobenzo[c]chromen-3-yl) (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate
| Molecular Formula | C31H25NO7 |
|---|---|
| Molecular Weight | 523.16 g/mol |
| LogP | 5.3979 |
| Topological Polar Surface Area | 104.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 523.1631 |
| Heavy Atoms | 39 |
| Complexity | 1680.3544 |
Chemical Identifiers
| CAS Number | 956044-73-8 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C3=C(C=C(C=C3)OC(=O)[C@H](CC4=CC=CC=C4)NC(=O)OCC5=CC=CC=C5)OC2=O |
Product Overview
(S)-8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate (CAS 956044-73-8), with molecular formula C31H25NO7 and molecular weight 523.16 g/mol. IUPAC: (8-methoxy-6-oxobenzo[c]chromen-3-yl) (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate.
Chemical Property Profile of (S)-8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate
Property Insights of (S)-8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate
The XLogP value of 5.3979 indicates that (S)-8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.07 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate. Following Lipinski's Rule of Five, (S)-8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (S)-8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate?
The CAS number of (S)-8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate is 956044-73-8.
What is the molecular formula of (S)-8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate?
The molecular formula of (S)-8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate is C31H25NO7.
What is the molecular weight of (S)-8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate?
The molecular weight of (S)-8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate is 523.16 g/mol.
Where can I buy (S)-8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate?
You can request a quote for (S)-8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for (S)-8-methoxy-6-oxo-6H-benzo[c]chromen-3-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.