TL;DR: N,N-Dimethyl-2-((4'-(thien-2''-yl)pyrimidin-2'-yl)thio)ethylamine (CAS 83726-78-7) is a chemical compound with molecular formula C12H15N3S2 and molecular weight 265.07074 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-dimethyl-2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanylethanamine
Also Known As: Dmtpte, 4-Thienyl-2-SEtNMe2-Pyrimidine, N,N-Dimethyl-2-((4'-(thien-2''-yl)pyrimidin-2'-yl)thio)ethylamine, J1.140.754D, N,N-dimethyl-2-(4-thiophen-2-ylpyrimidin-2-yl)sulfanylethanamine
| Molecular Formula | C12H15N3S2 |
| Molecular Weight | 265.07074 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 82.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 265.07074 Da |
| Heavy Atoms | 17 |
| Complexity | 226.0 |
| SMILES | CN(C)CCSC1=NC=CC(=N1)C2=CC=CS2 |
| InChIKey | CIALFTQGEPVUMB-UHFFFAOYSA-N |
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-Dimethyl-2-((4'-(thien-2''-yl)pyrimidin-2'-yl)thio)ethylamine. The TPSA of 82.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-Dimethyl-2-((4'-(thien-2''-yl)pyrimidin-2'-yl)thio)ethylamine. Following Lipinski's Rule of Five, N,N-Dimethyl-2-((4'-(thien-2''-yl)pyrimidin-2'-yl)thio)ethylamine has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N,N-Dimethyl-2-((4'-(thien-2''-yl)pyrimidin-2'-yl)thio)ethylamine is 83726-78-7.
The molecular formula of N,N-Dimethyl-2-((4'-(thien-2''-yl)pyrimidin-2'-yl)thio)ethylamine is C12H15N3S2.
The molecular weight of N,N-Dimethyl-2-((4'-(thien-2''-yl)pyrimidin-2'-yl)thio)ethylamine is 265.07074 g/mol.
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