(2S,3R)-6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylpentanoate
TL;DR: (2S,3R)-6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylpentanoate (CAS 956045-84-4) is a chemical compound with molecular formula C26H28ClNO6 and molecular weight 485.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-chloro-2-oxo-4-phenylchromen-7-yl) (2S,3R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate
Also Known As: (2S,3R)-6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylpentanoate, (6-chloro-2-oxo-4-phenylchromen-7-yl) (2S,3R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate
| Molecular Formula | C26H28ClNO6 |
|---|---|
| Molecular Weight | 485.16 g/mol |
| LogP | 5.9582 |
| Topological Polar Surface Area | 94.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 485.16052 |
| Heavy Atoms | 34 |
| Complexity | 1245.866 |
Chemical Identifiers
| CAS Number | 956045-84-4 |
|---|---|
| SMILES | CC[C@@H](C)[C@@H](C(=O)OC1=C(C=C2C(=CC(=O)OC2=C1)C3=CC=CC=C3)Cl)NC(=O)OC(C)(C)C |
Product Overview
(2S,3R)-6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylpentanoate (CAS 956045-84-4), with molecular formula C26H28ClNO6 and molecular weight 485.16 g/mol. IUPAC: (6-chloro-2-oxo-4-phenylchromen-7-yl) (2S,3R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate.
Chemical Property Profile of (2S,3R)-6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylpentanoate
Property Insights of (2S,3R)-6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylpentanoate
The XLogP value of 5.9582 indicates that (2S,3R)-6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylpentanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.84 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S,3R)-6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylpentanoate. Following Lipinski's Rule of Five, (2S,3R)-6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylpentanoate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2S,3R)-6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylpentanoate?
The CAS number of (2S,3R)-6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylpentanoate is 956045-84-4.
What is the molecular formula of (2S,3R)-6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylpentanoate?
The molecular formula of (2S,3R)-6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylpentanoate is C26H28ClNO6.
What is the molecular weight of (2S,3R)-6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylpentanoate?
The molecular weight of (2S,3R)-6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylpentanoate is 485.16 g/mol.
Where can I buy (2S,3R)-6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylpentanoate?
You can request a quote for (2S,3R)-6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylpentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S,3R)-6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylpentanoate?
Yes, KEHONG BIO provides custom synthesis services for (2S,3R)-6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl 2-((tert-butoxycarbonyl)amino)-3-methylpentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.