![trans-4-[({N-[(4-methylphenyl)sulfonyl]-L-isoleucyl}amino)methyl]cyclohexanecarboxylic acid structure](/static/products/117/1173675-37-0.webp)
trans-4-[({N-[(4-methylphenyl)sulfonyl]-L-isoleucyl}amino)methyl]cyclohexanecarboxylic acid
TL;DR: trans-4-[({N-[(4-methylphenyl)sulfonyl]-L-isoleucyl}amino)methyl]cyclohexanecarboxylic acid (CAS 1173675-37-0) is a chemical compound with molecular formula C21H32N2O5S and molecular weight 424.2032 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[[[(2S,3S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoyl]amino]methyl]cyclohexane-1-carboxylic acid
Also Known As: trans-4-[({N-[(4-methylphenyl)sulfonyl]-L-isoleucyl}amino)methyl]cyclohexanecarboxylic acid, (1S,4r)-4-(((2S,3S)-3-methyl-2-(4-methylphenylsulfonamido)pentanamido)methyl)cyclohexanecarboxylic acid, 4-[[[(2S,3S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoyl]amino]methyl]cyclohexane-1-carboxylic acid
Technical Specifications
| Molecular Formula | C21H32N2O5S |
| Molecular Weight | 424.2032 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 121.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 424.2032 Da |
| Heavy Atoms | 29 |
| Complexity | 644.0 |
| SMILES | CC[C@H](C)[C@@H](C(=O)NCC1CCC(CC1)C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C |
| InChIKey | IJYFLLFOOSORFE-LOTPSLMQSA-N |
Chemical Property Profile of trans-4-[({N-[(4-methylphenyl)sulfonyl]-L-isoleucyl}amino)methyl]cyclohexanecarboxylic acid
Property Insights of trans-4-[({N-[(4-methylphenyl)sulfonyl]-L-isoleucyl}amino)methyl]cyclohexanecarboxylic acid
The XLogP value of 3.3 indicates that trans-4-[({N-[(4-methylphenyl)sulfonyl]-L-isoleucyl}amino)methyl]cyclohexanecarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for trans-4-[({N-[(4-methylphenyl)sulfonyl]-L-isoleucyl}amino)methyl]cyclohexanecarboxylic acid. Following Lipinski's Rule of Five, trans-4-[({N-[(4-methylphenyl)sulfonyl]-L-isoleucyl}amino)methyl]cyclohexanecarboxylic acid has 3 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 trans-4-[({N-[(4-methylphenyl)sulfonyl]-L-isoleucyl}amino)methyl]cyclohexanecarboxylic acid?
The CAS number of trans-4-[({N-[(4-methylphenyl)sulfonyl]-L-isoleucyl}amino)methyl]cyclohexanecarboxylic acid is 1173675-37-0.
What is the molecular formula of trans-4-[({N-[(4-methylphenyl)sulfonyl]-L-isoleucyl}amino)methyl]cyclohexanecarboxylic acid?
The molecular formula of trans-4-[({N-[(4-methylphenyl)sulfonyl]-L-isoleucyl}amino)methyl]cyclohexanecarboxylic acid is C21H32N2O5S.
What is the molecular weight of trans-4-[({N-[(4-methylphenyl)sulfonyl]-L-isoleucyl}amino)methyl]cyclohexanecarboxylic acid?
The molecular weight of trans-4-[({N-[(4-methylphenyl)sulfonyl]-L-isoleucyl}amino)methyl]cyclohexanecarboxylic acid is 424.2032 g/mol.
Where can I buy trans-4-[({N-[(4-methylphenyl)sulfonyl]-L-isoleucyl}amino)methyl]cyclohexanecarboxylic acid?
You can request a quote for trans-4-[({N-[(4-methylphenyl)sulfonyl]-L-isoleucyl}amino)methyl]cyclohexanecarboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for trans-4-[({N-[(4-methylphenyl)sulfonyl]-L-isoleucyl}amino)methyl]cyclohexanecarboxylic acid?
Yes, CoreyChem provides custom synthesis services for trans-4-[({N-[(4-methylphenyl)sulfonyl]-L-isoleucyl}amino)methyl]cyclohexanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.