N-(2,3,5,6-Tetramethylbenzene-1-sulfonyl)-L-valine
TL;DR: N-(2,3,5,6-Tetramethylbenzene-1-sulfonyl)-L-valine (CAS 1009595-18-9) is a chemical compound with molecular formula C15H23NO4S and molecular weight 313.13477 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-3-methyl-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]butanoic acid
Also Known As: N-(2,3,5,6-Tetramethylbenzene-1-sulfonyl)-L-valine, (2S)-3-methyl-2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]butanoic acid, N-(2356-TETMETHLPHENLSULFON 1G., N-(2356-TETMETHLPHENLSUL 250MG., Valine, N-[(2,3,5,6-tetramethylphenyl)sulfonyl]-
Technical Specifications
| Molecular Formula | C15H23NO4S |
| Molecular Weight | 313.13477 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 91.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 313.13477 Da |
| Heavy Atoms | 21 |
| Complexity | 455.0 |
| SMILES | CC1=CC(=C(C(=C1C)S(=O)(=O)N[C@@H](C(C)C)C(=O)O)C)C |
| InChIKey | FSSJWNVCOOWYHL-ZDUSSCGKSA-N |
Chemical Property Profile of N-(2,3,5,6-Tetramethylbenzene-1-sulfonyl)-L-valine
Property Insights of N-(2,3,5,6-Tetramethylbenzene-1-sulfonyl)-L-valine
The XLogP value of 3.3 indicates that N-(2,3,5,6-Tetramethylbenzene-1-sulfonyl)-L-valine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,3,5,6-Tetramethylbenzene-1-sulfonyl)-L-valine. Following Lipinski's Rule of Five, N-(2,3,5,6-Tetramethylbenzene-1-sulfonyl)-L-valine has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(2,3,5,6-Tetramethylbenzene-1-sulfonyl)-L-valine?
The CAS number of N-(2,3,5,6-Tetramethylbenzene-1-sulfonyl)-L-valine is 1009595-18-9.
What is the molecular formula of N-(2,3,5,6-Tetramethylbenzene-1-sulfonyl)-L-valine?
The molecular formula of N-(2,3,5,6-Tetramethylbenzene-1-sulfonyl)-L-valine is C15H23NO4S.
What is the molecular weight of N-(2,3,5,6-Tetramethylbenzene-1-sulfonyl)-L-valine?
The molecular weight of N-(2,3,5,6-Tetramethylbenzene-1-sulfonyl)-L-valine is 313.13477 g/mol.
Where can I buy N-(2,3,5,6-Tetramethylbenzene-1-sulfonyl)-L-valine?
You can request a quote for N-(2,3,5,6-Tetramethylbenzene-1-sulfonyl)-L-valine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(2,3,5,6-Tetramethylbenzene-1-sulfonyl)-L-valine?
Yes, CoreyChem provides custom synthesis services for N-(2,3,5,6-Tetramethylbenzene-1-sulfonyl)-L-valine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.