![N-({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)isoleucine structure](/static/products/956/956923-60-7.png)
N-({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)isoleucine
TL;DR: N-({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)isoleucine (CAS 956923-60-7) is a chemical compound with molecular formula C19H28N2O5S and molecular weight 396.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R)-3-methyl-2-[[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]amino]pentanoic acid
Also Known As: (1-Tosylpiperidine-4-carbonyl)-L-alloisoleucine, AO-022/43451419, N-({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)isoleucine, (2S,3R)-3-methyl-2-[[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]amino]pentanoic acid, 3-methyl-2-[[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]amino]pentanoic Acid
| Molecular Formula | C19H28N2O5S |
|---|---|
| Molecular Weight | 396.17 g/mol |
| LogP | 2.01122 |
| Topological Polar Surface Area | 103.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 396.1719 |
| Heavy Atoms | 27 |
| Complexity | 767.7947 |
Chemical Identifiers
| CAS Number | 956923-60-7 |
|---|---|
| SMILES | CC[C@@H](C)[C@@H](C(=O)O)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C |
Product Overview
N-({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)isoleucine (CAS 956923-60-7), with molecular formula C19H28N2O5S and molecular weight 396.17 g/mol. IUPAC: (2S,3R)-3-methyl-2-[[1-(4-methylphenyl)sulfonylpiperidine-4-carbonyl]amino]pentanoic acid.
Chemical Property Profile of N-({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)isoleucine
Property Insights of N-({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)isoleucine
The XLogP value of 2.01122 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)isoleucine. The TPSA of 103.78 Ų falls within the moderate polarity range, balancing permeability and solubility for N-({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)isoleucine. Following Lipinski's Rule of Five, N-({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)isoleucine has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)isoleucine?
The CAS number of N-({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)isoleucine is 956923-60-7.
What is the molecular formula of N-({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)isoleucine?
The molecular formula of N-({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)isoleucine is C19H28N2O5S.
What is the molecular weight of N-({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)isoleucine?
The molecular weight of N-({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)isoleucine is 396.17 g/mol.
Where can I buy N-({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)isoleucine?
You can request a quote for N-({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)isoleucine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)isoleucine?
Yes, KEHONG BIO provides custom synthesis services for N-({1-[(4-methylphenyl)sulfonyl]-4-piperidinyl}carbonyl)isoleucine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.