![4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate structure](/static/products/294/294854-91-4.png)
4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate
TL;DR: 4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate (CAS 294854-91-4) is a chemical compound with molecular formula C26H21NO7 and molecular weight 459.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-oxo-3-phenoxychromen-7-yl) 3-(phenylmethoxycarbonylamino)propanoate
Also Known As: EiM07-30212, 4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate, (4-oxo-3-phenoxychromen-7-yl) 3-(phenylmethoxycarbonylamino)propanoate, 4-oxo-3-phenoxy-4H-chromen-7-yl 3-(((benzyloxy)carbonyl)amino)propanoate, 4-OXO-3-PHENOXY-4H-CHROMEN-7-YL 3-{[(BENZYLOXY)CARBONYL]AMINO}PROPANOATE
| Molecular Formula | C26H21NO7 |
|---|---|
| Molecular Weight | 459.13 g/mol |
| LogP | 4.8072 |
| Topological Polar Surface Area | 104.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 459.1318 |
| Heavy Atoms | 34 |
| Complexity | 1333.8766 |
Chemical Identifiers
| CAS Number | 294854-91-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)NCCC(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)OC4=CC=CC=C4 |
Product Overview
4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate (CAS 294854-91-4), with molecular formula C26H21NO7 and molecular weight 459.13 g/mol. IUPAC: (4-oxo-3-phenoxychromen-7-yl) 3-(phenylmethoxycarbonylamino)propanoate.
Chemical Property Profile of 4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate
Property Insights of 4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate
The XLogP value of 4.8072 indicates that 4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate 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 4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate. Following Lipinski's Rule of Five, 4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate 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 4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate?
The CAS number of 4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate is 294854-91-4.
What is the molecular formula of 4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate?
The molecular formula of 4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate is C26H21NO7.
What is the molecular weight of 4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate?
The molecular weight of 4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate is 459.13 g/mol.
Where can I buy 4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate?
You can request a quote for 4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate?
Yes, KEHONG BIO provides custom synthesis services for 4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.