C19H18Cl2N4OS
TL;DR: C19H18Cl2N4OS (CAS 1052529-14-2) is a chemical compound with molecular formula C19H18Cl2N4OS and molecular weight 420.05783 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S)-1-[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]-2-(1H-indol-3-yl)ethanamine;hydrochloride
Also Known As: (S)-1-(5-((4-chlorobenzyl)thio)-1,3,4-oxadiazol-2-yl)-2-(1H-indol-3-yl)ethanamine hydrochloride, (1S)-1-[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-oxadiazol-2-yl]-2-(1H-indol-3-yl)ethanamine hydrochloride
Technical Specifications
| Molecular Formula | C19H18Cl2N4OS |
| Molecular Weight | 420.05783 g/mol |
| XLogP | 5.1609 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 420.05783 Da |
| Heavy Atoms | 27 |
| Complexity | 451.0 |
| SMILES | C1=CC=C2C(=C1)C(=CN2)C[C@@H](C3=NN=C(O3)SCC4=CC=C(C=C4)Cl)N.Cl |
| InChIKey | JADMIWJINITSIH-NTISSMGPSA-N |
Chemical Property Profile of C19H18Cl2N4OS
Property Insights of C19H18Cl2N4OS
The XLogP value of 5.1609 indicates that C19H18Cl2N4OS is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C19H18Cl2N4OS. Following Lipinski's Rule of Five, C19H18Cl2N4OS has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of C19H18Cl2N4OS?
The CAS number of C19H18Cl2N4OS is 1052529-14-2.
What is the molecular formula of C19H18Cl2N4OS?
The molecular formula of C19H18Cl2N4OS is C19H18Cl2N4OS.
What is the molecular weight of C19H18Cl2N4OS?
The molecular weight of C19H18Cl2N4OS is 420.05783 g/mol.
Where can I buy C19H18Cl2N4OS?
You can request a quote for C19H18Cl2N4OS directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C19H18Cl2N4OS?
Yes, CoreyChem provides custom synthesis services for C19H18Cl2N4OS and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.