(S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)propanoate
TL;DR: (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)propanoate (CAS 957028-85-2) is a chemical compound with molecular formula C27H23NO7 and molecular weight 473.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(4-methoxyphenyl)-2-oxochromen-7-yl] (2S)-2-(phenylmethoxycarbonylamino)propanoate
Also Known As: (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)propanoate, [4-(4-methoxyphenyl)-2-oxo-chromen-7-yl] 2-phenylmethoxycarbonylaminopropanoate, [4-(4-methoxyphenyl)-2-oxochromen-7-yl] (2S)-2-(phenylmethoxycarbonylamino)propanoate
| Molecular Formula | C27H23NO7 |
|---|---|
| Molecular Weight | 473.15 g/mol |
| LogP | 4.6889 |
| Topological Polar Surface Area | 104.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 473.14746 |
| Heavy Atoms | 35 |
| Complexity | 1394.9884 |
Chemical Identifiers
| CAS Number | 957028-85-2 |
|---|---|
| SMILES | C[C@@H](C(=O)OC1=CC2=C(C=C1)C(=CC(=O)O2)C3=CC=C(C=C3)OC)NC(=O)OCC4=CC=CC=C4 |
Product Overview
(S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)propanoate (CAS 957028-85-2), with molecular formula C27H23NO7 and molecular weight 473.15 g/mol. IUPAC: [4-(4-methoxyphenyl)-2-oxochromen-7-yl] (2S)-2-(phenylmethoxycarbonylamino)propanoate.
Chemical Property Profile of (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)propanoate
Property Insights of (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)propanoate
The XLogP value of 4.6889 indicates that (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)propanoate 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)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)propanoate. Following Lipinski's Rule of Five, (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)propanoate has 1 hydrogen bond donor(s) and 7 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 (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)propanoate?
The CAS number of (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)propanoate is 957028-85-2.
What is the molecular formula of (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)propanoate?
The molecular formula of (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)propanoate is C27H23NO7.
What is the molecular weight of (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)propanoate?
The molecular weight of (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)propanoate is 473.15 g/mol.
Where can I buy (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)propanoate?
You can request a quote for (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)propanoate?
Yes, KEHONG BIO provides custom synthesis services for (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.