Sch 42495
TL;DR: Sch 42495 (CAS 136511-43-8) is a chemical compound with molecular formula C20H29NO4S2 and molecular weight 411.1538 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (2S)-2-[[(2S)-2-(acetylsulfanylmethyl)-3-(2-methylphenyl)propanoyl]amino]-4-methylsulfanylbutanoate
Also Known As: Sch 42495, N-(2(S)-(Acetylthiomethyl)-3-(2-methylphenyl)-1-oxopropyl)-L-methionine ethyl ester, ethyl (2S)-2-[[(2S)-2-(acetylsulfanylmethyl)-3-(2-methylphenyl)propanoyl]amino]-4-methylsulfanylbutanoate, L-Methionine,N-[(2S)-2-[(acetylthio)methyl]-3-(2-methylphenyl)-1-oxopropyl]-, ethyl ester, N-[(S)-2-(Acetylthiomethyl)-3-(2-methylphenyl)-1-oxopropyl]-L-methionine ethyl ester
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C20H29NO4S2 |
| Molecular Weight | 411.1538 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 123.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 13 |
| Exact Mass | 411.1538 Da |
| Heavy Atoms | 27 |
| Complexity | 487.0 |
| SMILES | CCOC(=O)[C@H](CCSC)NC(=O)[C@H](CC1=CC=CC=C1C)CSC(=O)C |
| InChIKey | ZVQXPUMRSJGLSF-MSOLQXFVSA-N |
Chemical Property Profile of Sch 42495
Property Insights of Sch 42495
The XLogP value of 3.6 indicates that Sch 42495 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Sch 42495. Following Lipinski's Rule of Five, Sch 42495 has 1 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 Sch 42495?
The CAS number of Sch 42495 is 136511-43-8.
What is the molecular formula of Sch 42495?
The molecular formula of Sch 42495 is C20H29NO4S2.
What is the molecular weight of Sch 42495?
The molecular weight of Sch 42495 is 411.1538 g/mol.
Where can I buy Sch 42495?
You can request a quote for Sch 42495 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Sch 42495?
Yes, CoreyChem provides custom synthesis services for Sch 42495 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.