(S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-methylpentanoate
TL;DR: (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-methylpentanoate (CAS 956044-41-0) is a chemical compound with molecular formula C27H31NO7 and molecular weight 481.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(4-methoxyphenyl)-2-oxochromen-7-yl] (2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate
Also Known As: (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-methylpentanoate, [4-(4-methoxyphenyl)-2-oxochromen-7-yl] (2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate
| Molecular Formula | C27H31NO7 |
|---|---|
| Molecular Weight | 481.21 g/mol |
| LogP | 5.3134 |
| Topological Polar Surface Area | 104.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 481.21005 |
| Heavy Atoms | 35 |
| Complexity | 1253.2452 |
Chemical Identifiers
| CAS Number | 956044-41-0 |
|---|---|
| SMILES | CC(C)C[C@@H](C(=O)OC1=CC2=C(C=C1)C(=CC(=O)O2)C3=CC=C(C=C3)OC)NC(=O)OC(C)(C)C |
Product Overview
(S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-methylpentanoate (CAS 956044-41-0), with molecular formula C27H31NO7 and molecular weight 481.21 g/mol. IUPAC: [4-(4-methoxyphenyl)-2-oxochromen-7-yl] (2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate.
Chemical Property Profile of (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-methylpentanoate
Property Insights of (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-methylpentanoate
The XLogP value of 5.3134 indicates that (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-methylpentanoate 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)-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-methylpentanoate. Following Lipinski's Rule of Five, (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-methylpentanoate 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)-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-methylpentanoate?
The CAS number of (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-methylpentanoate is 956044-41-0.
What is the molecular formula of (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-methylpentanoate?
The molecular formula of (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-methylpentanoate is C27H31NO7.
What is the molecular weight of (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-methylpentanoate?
The molecular weight of (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-methylpentanoate is 481.21 g/mol.
Where can I buy (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-methylpentanoate?
You can request a quote for (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-methylpentanoate 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)-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-methylpentanoate?
Yes, KEHONG BIO provides custom synthesis services for (S)-4-(4-methoxyphenyl)-2-oxo-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-4-methylpentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.