N-(Phenylmethanesulfonyl)leucylleucine
TL;DR: N-(Phenylmethanesulfonyl)leucylleucine (CAS 7474-68-2) is a chemical compound with molecular formula C19H30N2O5S and molecular weight 398.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-(benzylsulfonylamino)-4-methylpentanoyl]amino]-4-methylpentanoic acid
Also Known As: N-(Phenylmethanesulfonyl)leucylleucine, 2-[[2-(benzylsulfonylamino)-4-methylpentanoyl]amino]-4-methylpentanoic acid, 2-[[2-(benzylsulfonylamino)-4-methyl-pentanoyl]amino]-4-methyl-pentanoic acid
| Molecular Formula | C19H30N2O5S |
|---|---|
| Molecular Weight | 398.19 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 398.18753 |
| Heavy Atoms | 27 |
| Complexity | 577.0 |
Chemical Identifiers
| CAS Number | 7474-68-2 |
|---|---|
| SMILES | CC(C)CC(C(=O)NC(CC(C)C)C(=O)O)NS(=O)(=O)CC1=CC=CC=C1 |
| InChIKey | KZJWGBREBONQFI-UHFFFAOYSA-N |
Product Overview
N-(Phenylmethanesulfonyl)leucylleucine (CAS 7474-68-2), with molecular formula C19H30N2O5S and molecular weight 398.19 g/mol. IUPAC: 2-[[2-(benzylsulfonylamino)-4-methylpentanoyl]amino]-4-methylpentanoic acid.
Chemical Property Profile of N-(Phenylmethanesulfonyl)leucylleucine
Property Insights of N-(Phenylmethanesulfonyl)leucylleucine
The XLogP value of 3.2 indicates that N-(Phenylmethanesulfonyl)leucylleucine 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 N-(Phenylmethanesulfonyl)leucylleucine. Following Lipinski's Rule of Five, N-(Phenylmethanesulfonyl)leucylleucine 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
Frequently Asked Questions
What is the CAS number of N-(Phenylmethanesulfonyl)leucylleucine?
The CAS number of N-(Phenylmethanesulfonyl)leucylleucine is 7474-68-2.
What is the molecular formula of N-(Phenylmethanesulfonyl)leucylleucine?
The molecular formula of N-(Phenylmethanesulfonyl)leucylleucine is C19H30N2O5S.
What is the molecular weight of N-(Phenylmethanesulfonyl)leucylleucine?
The molecular weight of N-(Phenylmethanesulfonyl)leucylleucine is 398.19 g/mol.
Where can I buy N-(Phenylmethanesulfonyl)leucylleucine?
You can request a quote for N-(Phenylmethanesulfonyl)leucylleucine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(Phenylmethanesulfonyl)leucylleucine?
Yes, KEHONG BIO provides custom synthesis services for N-(Phenylmethanesulfonyl)leucylleucine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.