4-(Methylsulfanyl)-2-(naphthalene-2-sulfonamido)butanoic acid
TL;DR: 4-(Methylsulfanyl)-2-(naphthalene-2-sulfonamido)butanoic acid (CAS 1396965-15-3) is a chemical compound with molecular formula C15H17NO4S2 and molecular weight 339.0599 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methylsulfanyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid
Also Known As: 4-(methylsulfanyl)-2-(naphthalene-2-sulfonamido)butanoic acid, 4-(methylthio)-2-[(2-naphthylsulfonyl)amino]butanoic acid, 4-methylsulfanyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid, 4-(methylthio)-2-(2-naphthylsulfonylamino)butyric acid, 4-(methylthio)-2-(2-naphthalenylsulfonylamino)butanoic acid
Technical Specifications
| Molecular Formula | C15H17NO4S2 |
| Molecular Weight | 339.0599 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 117.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 339.0599 Da |
| Heavy Atoms | 22 |
| Complexity | 474.0 |
| SMILES | CSCCC(C(=O)O)NS(=O)(=O)C1=CC2=CC=CC=C2C=C1 |
| InChIKey | ALNVNZHBLAJGTP-UHFFFAOYSA-N |
Chemical Property Profile of 4-(Methylsulfanyl)-2-(naphthalene-2-sulfonamido)butanoic acid
Property Insights of 4-(Methylsulfanyl)-2-(naphthalene-2-sulfonamido)butanoic acid
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Methylsulfanyl)-2-(naphthalene-2-sulfonamido)butanoic acid. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Methylsulfanyl)-2-(naphthalene-2-sulfonamido)butanoic acid. Following Lipinski's Rule of Five, 4-(Methylsulfanyl)-2-(naphthalene-2-sulfonamido)butanoic acid has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(Methylsulfanyl)-2-(naphthalene-2-sulfonamido)butanoic acid?
The CAS number of 4-(Methylsulfanyl)-2-(naphthalene-2-sulfonamido)butanoic acid is 1396965-15-3.
What is the molecular formula of 4-(Methylsulfanyl)-2-(naphthalene-2-sulfonamido)butanoic acid?
The molecular formula of 4-(Methylsulfanyl)-2-(naphthalene-2-sulfonamido)butanoic acid is C15H17NO4S2.
What is the molecular weight of 4-(Methylsulfanyl)-2-(naphthalene-2-sulfonamido)butanoic acid?
The molecular weight of 4-(Methylsulfanyl)-2-(naphthalene-2-sulfonamido)butanoic acid is 339.0599 g/mol.
Where can I buy 4-(Methylsulfanyl)-2-(naphthalene-2-sulfonamido)butanoic acid?
You can request a quote for 4-(Methylsulfanyl)-2-(naphthalene-2-sulfonamido)butanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(Methylsulfanyl)-2-(naphthalene-2-sulfonamido)butanoic acid?
Yes, CoreyChem provides custom synthesis services for 4-(Methylsulfanyl)-2-(naphthalene-2-sulfonamido)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.