TL;DR: Trpyrth (CAS 146404-37-7) is a chemical compound with molecular formula C7H7N5OS and molecular weight 209.03712 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
13-thia-3,4,5,7,9-pentazatricyclo[7.4.0.02,6]trideca-1,4,6-trien-8-one
Also Known As: Trpyrth, 7H-8,9-dihydro- triazolo pyrimido thiazine-5 -one, 7H-8,9-Dihydro-(1,2,3)triazolo(4',5'-4,5)pyrimido(6,1-b)(1,3)thiazine-5(1H)-one, 9H-7,8-Dihydro-(1,2,3)triazolo(4',5'-4,5)pyrimido(6,1-b)(1,3)thiazine-5(3H)-one, 1,7,8,9-tetrahydrotriazolo[1,2]pyrimido[4,5-b][1,3]thiazin-5-one
| Molecular Formula | C7H7N5OS |
| Molecular Weight | 209.03712 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 94.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 209.03712 Da |
| Heavy Atoms | 14 |
| Complexity | 399.0 |
| SMILES | C1CN2C(=C3C(=NC2=O)N=NN3)SC1 |
| InChIKey | TVYQLGHZPCLRIJ-UHFFFAOYSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trpyrth. The TPSA of 94.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Trpyrth. Following Lipinski's Rule of Five, Trpyrth has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Trpyrth is 146404-37-7.
The molecular formula of Trpyrth is C7H7N5OS.
The molecular weight of Trpyrth is 209.03712 g/mol.
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