TL;DR: 5-ethylsulfanyl-1H-1,2,4-triazole (CAS 15182-35-1) is a chemical compound with molecular formula C4H7N3S and molecular weight 129.03607 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-ethylsulfanyl-1H-1,2,4-triazole
Also Known As: 3-ethylthio-4h-1,2,4-triazole, 5-ethylsulfanyl-1H-1,2,4-triazole, 3-(ethylthio)-4H-1,2,4-triazole, 3-ethylthio-1,2,4-triazole, 3-ethylthio-1,2,4 -triazole
| Molecular Formula | C4H7N3S |
| Molecular Weight | 129.03607 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 66.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 129.03607 Da |
| Heavy Atoms | 8 |
| Complexity | 68.0 |
| SMILES | CCSC1=NC=NN1 |
| InChIKey | UHIOXHCBRKQOTQ-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-ethylsulfanyl-1H-1,2,4-triazole. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-ethylsulfanyl-1H-1,2,4-triazole. Following Lipinski's Rule of Five, 5-ethylsulfanyl-1H-1,2,4-triazole has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-ethylsulfanyl-1H-1,2,4-triazole is 15182-35-1.
The molecular formula of 5-ethylsulfanyl-1H-1,2,4-triazole is C4H7N3S.
The molecular weight of 5-ethylsulfanyl-1H-1,2,4-triazole is 129.03607 g/mol.
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