1-Naphthalenylsulfonyl-Ile-Trp-aldehyde
TL;DR: 1-Naphthalenylsulfonyl-Ile-Trp-aldehyde (CAS 161709-56-4) is a chemical compound with molecular formula C27H29N3O4S and molecular weight 491.18787 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3S)-N-[(2S)-1-(1H-indol-3-yl)-3-oxopropan-2-yl]-3-methyl-2-(naphthalen-1-ylsulfonylamino)pentanamide
Also Known As: 1-Naphthalenylsulfonyl-Ile-Trp-aldehyde, Cathepsin L-IN-4, Cathepsin L Inhibitor IV, N-(1-Naphthalenylsulfonyl)-Ile-Trp-aldehyde, N-(1Naphthalenylsulfonyl)- IW-CHO
Technical Specifications
| Molecular Formula | C27H29N3O4S |
| Molecular Weight | 491.18787 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 117.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 491.18787 Da |
| Heavy Atoms | 35 |
| Complexity | 829.0 |
| SMILES | CC[C@H](C)[C@@H](C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C=O)NS(=O)(=O)C3=CC=CC4=CC=CC=C43 |
| InChIKey | FFPHAWVFZQFOJA-JCWFFFCVSA-N |
Chemical Property Profile of 1-Naphthalenylsulfonyl-Ile-Trp-aldehyde
Property Insights of 1-Naphthalenylsulfonyl-Ile-Trp-aldehyde
The XLogP value of 4.9 indicates that 1-Naphthalenylsulfonyl-Ile-Trp-aldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Naphthalenylsulfonyl-Ile-Trp-aldehyde. Following Lipinski's Rule of Five, 1-Naphthalenylsulfonyl-Ile-Trp-aldehyde has 3 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 1-Naphthalenylsulfonyl-Ile-Trp-aldehyde?
The CAS number of 1-Naphthalenylsulfonyl-Ile-Trp-aldehyde is 161709-56-4.
What is the molecular formula of 1-Naphthalenylsulfonyl-Ile-Trp-aldehyde?
The molecular formula of 1-Naphthalenylsulfonyl-Ile-Trp-aldehyde is C27H29N3O4S.
What is the molecular weight of 1-Naphthalenylsulfonyl-Ile-Trp-aldehyde?
The molecular weight of 1-Naphthalenylsulfonyl-Ile-Trp-aldehyde is 491.18787 g/mol.
Where can I buy 1-Naphthalenylsulfonyl-Ile-Trp-aldehyde?
You can request a quote for 1-Naphthalenylsulfonyl-Ile-Trp-aldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Naphthalenylsulfonyl-Ile-Trp-aldehyde?
Yes, CoreyChem provides custom synthesis services for 1-Naphthalenylsulfonyl-Ile-Trp-aldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.