TL;DR: 2-Amino-5-(aminomethyl)-1,3-thiazol-4-one (CAS 111506-20-8) is a chemical compound with molecular formula C4H7N3OS and molecular weight 145.03099 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-5-(aminomethyl)-1,3-thiazol-4-one
Also Known As: 2-amino-5-(aminomethyl)-1,3-thiazol-4-one, 2-amino-5-(aminomethyl)-4(5H)-Thiazolone, 4(5H)-Thiazolone, 2-amino-5-(aminomethyl)-, 2-amino-4-oxo-5-aminomethyl-2-thiazoline, 2-amino-5-(aminomethyl)thiazol-4(5H)-one
| Molecular Formula | C4H7N3OS |
| Molecular Weight | 145.03099 g/mol |
| XLogP | -0.6 |
| Topological Polar Surface Area (TPSA) | 107.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 145.03099 Da |
| Heavy Atoms | 9 |
| Complexity | 167.0 |
| SMILES | C(C1C(=O)N=C(S1)N)N |
| InChIKey | WJDLUKHDNJUIIK-UHFFFAOYSA-N |
The XLogP value of -0.6 indicates that 2-Amino-5-(aminomethyl)-1,3-thiazol-4-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-5-(aminomethyl)-1,3-thiazol-4-one. Following Lipinski's Rule of Five, 2-Amino-5-(aminomethyl)-1,3-thiazol-4-one has 2 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 2-Amino-5-(aminomethyl)-1,3-thiazol-4-one is 111506-20-8.
The molecular formula of 2-Amino-5-(aminomethyl)-1,3-thiazol-4-one is C4H7N3OS.
The molecular weight of 2-Amino-5-(aminomethyl)-1,3-thiazol-4-one is 145.03099 g/mol.
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