TL;DR: Ethylamine, N,N-diethyl-2-(o-tolylthio)- (CAS 63918-09-2) is a chemical compound with molecular formula C13H21NS and molecular weight 223.13947 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-diethyl-2-(2-methylphenyl)sulfanylethanamine
Also Known As: Asymbescaline, USAF A-12632, N,N-Diethyl-2- ethanamine, N,N-Diethyl-beta-(o-tolylthio) ethylamine, ETHYLAMINE, N,N-DIETHYL-2-(o-TOLYLTHIO)-
| Molecular Formula | C13H21NS |
| Molecular Weight | 223.13947 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 28.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 223.13947 Da |
| Heavy Atoms | 15 |
| Complexity | 157.0 |
| SMILES | CCN(CC)CCSC1=CC=CC=C1C |
| InChIKey | NUBSVZKBUCRIBZ-UHFFFAOYSA-N |
The XLogP value of 3.6 indicates that Ethylamine, N,N-diethyl-2-(o-tolylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.5 Ų, Ethylamine, N,N-diethyl-2-(o-tolylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethylamine, N,N-diethyl-2-(o-tolylthio)- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Ethylamine, N,N-diethyl-2-(o-tolylthio)- is 63918-09-2.
The molecular formula of Ethylamine, N,N-diethyl-2-(o-tolylthio)- is C13H21NS.
The molecular weight of Ethylamine, N,N-diethyl-2-(o-tolylthio)- is 223.13947 g/mol.
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