(S)-8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate
TL;DR: (S)-8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate (CAS 956323-75-4) is a chemical compound with molecular formula C25H29NO7 and molecular weight 455.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8-methoxy-4-methyl-6-oxobenzo[c]chromen-3-yl) (2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate
Also Known As: (S)-8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate, 8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl N-(tert-butoxycarbonyl)-L-valinate, (8-methoxy-4-methyl-6-oxobenzo[c]chromen-3-yl) (2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate
| Molecular Formula | C25H29NO7 |
|---|---|
| Molecular Weight | 455.19 g/mol |
| LogP | 4.71792 |
| Topological Polar Surface Area | 104.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 455.1944 |
| Heavy Atoms | 33 |
| Complexity | 1267.7002 |
Chemical Identifiers
| CAS Number | 956323-75-4 |
|---|---|
| SMILES | CC1=C(C=CC2=C1OC(=O)C3=C2C=CC(=C3)OC)OC(=O)[C@H](C(C)C)NC(=O)OC(C)(C)C |
Product Overview
(S)-8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate (CAS 956323-75-4), with molecular formula C25H29NO7 and molecular weight 455.19 g/mol. IUPAC: (8-methoxy-4-methyl-6-oxobenzo[c]chromen-3-yl) (2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate.
Chemical Property Profile of (S)-8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate
Property Insights of (S)-8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate
The XLogP value of 4.71792 indicates that (S)-8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate 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)-8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate. Following Lipinski's Rule of Five, (S)-8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate 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)-8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate?
The CAS number of (S)-8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate is 956323-75-4.
What is the molecular formula of (S)-8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate?
The molecular formula of (S)-8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate is C25H29NO7.
What is the molecular weight of (S)-8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate?
The molecular weight of (S)-8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate is 455.19 g/mol.
Where can I buy (S)-8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate?
You can request a quote for (S)-8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate?
Yes, KEHONG BIO provides custom synthesis services for (S)-8-methoxy-4-methyl-6-oxo-6H-benzo[c]chromen-3-yl 2-((tert-butoxycarbonyl)amino)-3-methylbutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.