4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-tryptophanate
TL;DR: 4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-tryptophanate (CAS 1173671-97-0) is a chemical compound with molecular formula C30H28N2O6S and molecular weight 544.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-ethyl-8-methyl-2-oxochromen-7-yl) (2S)-3-(1H-indol-3-yl)-2-[(4-methylphenyl)sulfonylamino]propanoate
Also Known As: 4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-tryptophanate, (4-ethyl-8-methyl-2-oxochromen-7-yl) (2S)-3-(1H-indol-3-yl)-2-[(4-methylphenyl)sulfonylamino]propanoate, (S)-4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl 3-(1H-indol-3-yl)-2-(4-methylphenylsulfonamido)propanoate, 4-ETHYL-8-METHYL-2-OXO-2H-CHROMEN-7-YL 3-(1H-INDOL-3-YL)-2-(4-METHYLBENZENESULFONAMIDO)PROPANOATE
| Molecular Formula | C30H28N2O6S |
|---|---|
| Molecular Weight | 544.17 g/mol |
| LogP | 4.94874 |
| Topological Polar Surface Area | 118.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 544.1668 |
| Heavy Atoms | 39 |
| Complexity | 1852.8533 |
Chemical Identifiers
| CAS Number | 1173671-97-0 |
|---|---|
| SMILES | CCC1=CC(=O)OC2=C1C=CC(=C2C)OC(=O)[C@H](CC3=CNC4=CC=CC=C43)NS(=O)(=O)C5=CC=C(C=C5)C |
Product Overview
4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-tryptophanate (CAS 1173671-97-0), with molecular formula C30H28N2O6S and molecular weight 544.17 g/mol. IUPAC: (4-ethyl-8-methyl-2-oxochromen-7-yl) (2S)-3-(1H-indol-3-yl)-2-[(4-methylphenyl)sulfonylamino]propanoate.
Chemical Property Profile of 4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-tryptophanate
Property Insights of 4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-tryptophanate
The XLogP value of 4.94874 indicates that 4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-tryptophanate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-tryptophanate. Following Lipinski's Rule of Five, 4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-tryptophanate has 2 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 4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-tryptophanate?
The CAS number of 4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-tryptophanate is 1173671-97-0.
What is the molecular formula of 4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-tryptophanate?
The molecular formula of 4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-tryptophanate is C30H28N2O6S.
What is the molecular weight of 4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-tryptophanate?
The molecular weight of 4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-tryptophanate is 544.17 g/mol.
Where can I buy 4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-tryptophanate?
You can request a quote for 4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-tryptophanate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-tryptophanate?
Yes, KEHONG BIO provides custom synthesis services for 4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-tryptophanate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.