![3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-((tert-butoxycarbonyl)amino)hexanoate structure](/static/products/374/374701-72-1.png)
3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-((tert-butoxycarbonyl)amino)hexanoate
TL;DR: 3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-((tert-butoxycarbonyl)amino)hexanoate (CAS 374701-72-1) is a chemical compound with molecular formula C30H35NO8 and molecular weight 537.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxochromen-7-yl] 6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate
Also Known As: 3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-((tert-butoxycarbonyl)amino)hexanoate, [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxochromen-7-yl] 6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate, 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-[(tert-butoxycarbonyl)amino]hexanoate
| Molecular Formula | C30H35NO8 |
|---|---|
| Molecular Weight | 537.24 g/mol |
| LogP | 5.92022 |
| Topological Polar Surface Area | 113.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 537.23627 |
| Heavy Atoms | 39 |
| Complexity | 1402.5632 |
Chemical Identifiers
| CAS Number | 374701-72-1 |
|---|---|
| SMILES | CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)CCCCCNC(=O)OC(C)(C)C)C3=CC4=C(C=C3)OCCCO4 |
Product Overview
3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-((tert-butoxycarbonyl)amino)hexanoate (CAS 374701-72-1), with molecular formula C30H35NO8 and molecular weight 537.24 g/mol. IUPAC: [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxochromen-7-yl] 6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate.
Chemical Property Profile of 3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-((tert-butoxycarbonyl)amino)hexanoate
Property Insights of 3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-((tert-butoxycarbonyl)amino)hexanoate
The XLogP value of 5.92022 indicates that 3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-((tert-butoxycarbonyl)amino)hexanoate 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-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-((tert-butoxycarbonyl)amino)hexanoate. Following Lipinski's Rule of Five, 3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-((tert-butoxycarbonyl)amino)hexanoate 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-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-((tert-butoxycarbonyl)amino)hexanoate?
The CAS number of 3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-((tert-butoxycarbonyl)amino)hexanoate is 374701-72-1.
What is the molecular formula of 3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-((tert-butoxycarbonyl)amino)hexanoate?
The molecular formula of 3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-((tert-butoxycarbonyl)amino)hexanoate is C30H35NO8.
What is the molecular weight of 3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-((tert-butoxycarbonyl)amino)hexanoate?
The molecular weight of 3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-((tert-butoxycarbonyl)amino)hexanoate is 537.24 g/mol.
Where can I buy 3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-((tert-butoxycarbonyl)amino)hexanoate?
You can request a quote for 3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-((tert-butoxycarbonyl)amino)hexanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-((tert-butoxycarbonyl)amino)hexanoate?
Yes, KEHONG BIO provides custom synthesis services for 3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl 6-((tert-butoxycarbonyl)amino)hexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.