3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-4H-chromen-7-yl 3-(((benzyloxy)carbonyl)amino)propanoate
TL;DR: 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-4H-chromen-7-yl 3-(((benzyloxy)carbonyl)amino)propanoate (CAS 374698-33-6) is a chemical compound with molecular formula C28H23NO8 and molecular weight 501.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxochromen-7-yl] 3-(phenylmethoxycarbonylamino)propanoate
Also Known As: 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-4H-chromen-7-yl 3-(((benzyloxy)carbonyl)amino)propanoate, [3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxochromen-7-yl] 3-(phenylmethoxycarbonylamino)propanoate, 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate
| Molecular Formula | C28H23NO8 |
|---|---|
| Molecular Weight | 501.14 g/mol |
| LogP | 4.4531 |
| Topological Polar Surface Area | 113.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 501.14236 |
| Heavy Atoms | 37 |
| Complexity | 1495.5868 |
Chemical Identifiers
| CAS Number | 374698-33-6 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)C3=COC4=C(C3=O)C=CC(=C4)OC(=O)CCNC(=O)OCC5=CC=CC=C5 |
Product Overview
3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-4H-chromen-7-yl 3-(((benzyloxy)carbonyl)amino)propanoate (CAS 374698-33-6), with molecular formula C28H23NO8 and molecular weight 501.14 g/mol. IUPAC: [3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxochromen-7-yl] 3-(phenylmethoxycarbonylamino)propanoate.
Chemical Property Profile of 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-4H-chromen-7-yl 3-(((benzyloxy)carbonyl)amino)propanoate
Property Insights of 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-4H-chromen-7-yl 3-(((benzyloxy)carbonyl)amino)propanoate
The XLogP value of 4.4531 indicates that 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-4H-chromen-7-yl 3-(((benzyloxy)carbonyl)amino)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-4H-chromen-7-yl 3-(((benzyloxy)carbonyl)amino)propanoate. Following Lipinski's Rule of Five, 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-4H-chromen-7-yl 3-(((benzyloxy)carbonyl)amino)propanoate has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-4H-chromen-7-yl 3-(((benzyloxy)carbonyl)amino)propanoate?
The CAS number of 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-4H-chromen-7-yl 3-(((benzyloxy)carbonyl)amino)propanoate is 374698-33-6.
What is the molecular formula of 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-4H-chromen-7-yl 3-(((benzyloxy)carbonyl)amino)propanoate?
The molecular formula of 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-4H-chromen-7-yl 3-(((benzyloxy)carbonyl)amino)propanoate is C28H23NO8.
What is the molecular weight of 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-4H-chromen-7-yl 3-(((benzyloxy)carbonyl)amino)propanoate?
The molecular weight of 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-4H-chromen-7-yl 3-(((benzyloxy)carbonyl)amino)propanoate is 501.14 g/mol.
Where can I buy 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-4H-chromen-7-yl 3-(((benzyloxy)carbonyl)amino)propanoate?
You can request a quote for 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-4H-chromen-7-yl 3-(((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 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-4H-chromen-7-yl 3-(((benzyloxy)carbonyl)amino)propanoate?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-4H-chromen-7-yl 3-(((benzyloxy)carbonyl)amino)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.