cis-LY393053
TL;DR: cis-LY393053 (CAS 394735-81-0) is a chemical compound with molecular formula C21H21NO4S and molecular weight 383.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(1S)-1-amino-1-carboxy-2-(9H-thioxanthen-9-yl)ethyl]cyclobutane-1-carboxylic acid
Also Known As: cis-LY393053, 9H-Thioxanthene-9-propanoic acid, alpha-amino-alpha-(cis-3-carboxycyclobutyl)-, (alphaS)-, 3-[(1S)-1-amino-1-carboxy-2-(9H-thioxanthen-9-yl)ethyl]cyclobutane-1-carboxylic acid, 2-amino-2(S)-(3-cis-carboxycyclobutyl-3-(9-thioxanthen-9-yl)propionic acid), 3-[1-Amino-1-carboxy-2-(9H-thioxanthen-9-yl)-ethyl]-cyclobutanecarboxylic acid(LY393675)
| Molecular Formula | C21H21NO4S |
|---|---|
| Molecular Weight | 383.12 g/mol |
| LogP | 3.5661 |
| Topological Polar Surface Area | 100.62 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 383.11914 |
| Heavy Atoms | 27 |
| Complexity | 863.0596 |
Chemical Identifiers
| CAS Number | 394735-81-0 |
|---|---|
| SMILES | C1C(CC1[C@@](CC2C3=CC=CC=C3SC4=CC=CC=C24)(C(=O)O)N)C(=O)O |
Product Overview
cis-LY393053 (CAS 394735-81-0), with molecular formula C21H21NO4S and molecular weight 383.12 g/mol. IUPAC: 3-[(1S)-1-amino-1-carboxy-2-(9H-thioxanthen-9-yl)ethyl]cyclobutane-1-carboxylic acid.
Chemical Property Profile of cis-LY393053
Property Insights of cis-LY393053
The XLogP value of 3.5661 indicates that cis-LY393053 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.62 Ų falls within the moderate polarity range, balancing permeability and solubility for cis-LY393053. Following Lipinski's Rule of Five, cis-LY393053 has 3 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 cis-LY393053?
The CAS number of cis-LY393053 is 394735-81-0.
What is the molecular formula of cis-LY393053?
The molecular formula of cis-LY393053 is C21H21NO4S.
What is the molecular weight of cis-LY393053?
The molecular weight of cis-LY393053 is 383.12 g/mol.
Where can I buy cis-LY393053?
You can request a quote for cis-LY393053 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-LY393053?
Yes, KEHONG BIO provides custom synthesis services for cis-LY393053 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.