(S)-4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate
TL;DR: (S)-4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate (CAS 956739-64-3) is a chemical compound with molecular formula C34H29NO7 and molecular weight 563.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(4-methoxyphenyl)-8-methyl-2-oxochromen-7-yl] (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate
Also Known As: (S)-4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate, [4-(4-methoxyphenyl)-8-methyl-2-oxo-chromen-7-yl] 3-phenyl-2-phenylmethoxycarbonylamino-propanoate, [4-(4-methoxyphenyl)-8-methyl-2-oxochromen-7-yl] (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate, 4-(4-METHOXYPHENYL)-8-METHYL-2-OXO-2H-CHROMEN-7-YL 2-{[(BENZYLOXY)CARBONYL]AMINO}-3-PHENYLPROPANOATE, 4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-yl N-[(benzyloxy)carbonyl]-L-phenylalaninate
| Molecular Formula | C34H29NO7 |
|---|---|
| Molecular Weight | 563.19 g/mol |
| LogP | 6.22012 |
| Topological Polar Surface Area | 104.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 563.1944 |
| Heavy Atoms | 42 |
| Complexity | 1747.0605 |
Chemical Identifiers
| CAS Number | 956739-64-3 |
|---|---|
| SMILES | CC1=C(C=CC2=C1OC(=O)C=C2C3=CC=C(C=C3)OC)OC(=O)[C@H](CC4=CC=CC=C4)NC(=O)OCC5=CC=CC=C5 |
Product Overview
(S)-4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate (CAS 956739-64-3), with molecular formula C34H29NO7 and molecular weight 563.19 g/mol. IUPAC: [4-(4-methoxyphenyl)-8-methyl-2-oxochromen-7-yl] (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate.
Chemical Property Profile of (S)-4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate
Property Insights of (S)-4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate
The XLogP value of 6.22012 indicates that (S)-4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-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)-4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate. Following Lipinski's Rule of Five, (S)-4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-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)-4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate?
The CAS number of (S)-4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate is 956739-64-3.
What is the molecular formula of (S)-4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate?
The molecular formula of (S)-4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate is C34H29NO7.
What is the molecular weight of (S)-4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate?
The molecular weight of (S)-4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate is 563.19 g/mol.
Where can I buy (S)-4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate?
You can request a quote for (S)-4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-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)-4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for (S)-4-(4-methoxyphenyl)-8-methyl-2-oxo-2H-chromen-7-yl 2-(((benzyloxy)carbonyl)amino)-3-phenylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.