![(3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate structure](/static/products/100/1008670-12-9.png)
(3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate
TL;DR: (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate (CAS 1008670-12-9) is a chemical compound with molecular formula C30H31NO6S and molecular weight 533.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate
Also Known As: (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate
| Molecular Formula | C30H31NO6S |
|---|---|
| Molecular Weight | 533.19 g/mol |
| LogP | 5.36166 |
| Topological Polar Surface Area | 102.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 533.1872 |
| Heavy Atoms | 38 |
| Complexity | 1623.9149 |
Chemical Identifiers
| CAS Number | 1008670-12-9 |
|---|---|
| SMILES | CCC[C@H](C(=O)OC1=CC(=CC2=C1C(=C(C(=O)O2)CC3=CC=CC=C3)C)C)NS(=O)(=O)C4=CC=C(C=C4)C |
Product Overview
(3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate (CAS 1008670-12-9), with molecular formula C30H31NO6S and molecular weight 533.19 g/mol. IUPAC: (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate.
Chemical Property Profile of (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate
Property Insights of (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate
The XLogP value of 5.36166 indicates that (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.68 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate. Following Lipinski's Rule of Five, (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate 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 (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate?
The CAS number of (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate is 1008670-12-9.
What is the molecular formula of (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate?
The molecular formula of (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate is C30H31NO6S.
What is the molecular weight of (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate?
The molecular weight of (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate is 533.19 g/mol.
Where can I buy (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate?
You can request a quote for (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate?
Yes, KEHONG BIO provides custom synthesis services for (3-benzyl-4,7-dimethyl-2-oxochromen-5-yl) (2R)-2-[(4-methylphenyl)sulfonylamino]pentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.