Sch-42495 racemate
TL;DR: Sch-42495 racemate (CAS 145841-10-7) 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 2-[[2-(acetylsulfanylmethyl)-3-(2-methylphenyl)propanoyl]amino]-4-methylsulfanylbutanoate
Also Known As: Sch-42495 racemate, Sch 42495, N-(2(S)-(Acetylthiomethyl)-3-(2-methylphenyl)-1-oxopropyl)-L-methionine ethyl ester
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(CCSC)NC(=O)C(CC1=CC=CC=C1C)CSC(=O)C |
| InChIKey | ZVQXPUMRSJGLSF-UHFFFAOYSA-N |
Chemical Property Profile of Sch-42495 racemate
Property Insights of Sch-42495 racemate
The XLogP value of 3.6 indicates that Sch-42495 racemate 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 racemate. Following Lipinski's Rule of Five, Sch-42495 racemate 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 racemate?
The CAS number of Sch-42495 racemate is 145841-10-7.
What is the molecular formula of Sch-42495 racemate?
The molecular formula of Sch-42495 racemate is C20H29NO4S2.
What is the molecular weight of Sch-42495 racemate?
The molecular weight of Sch-42495 racemate is 411.1538 g/mol.
Where can I buy Sch-42495 racemate?
You can request a quote for Sch-42495 racemate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Sch-42495 racemate?
Yes, CoreyChem provides custom synthesis services for Sch-42495 racemate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.