TL;DR: 3-(2-aminothiazol-4-yl)-7-hydroxy-2H-chromen-2-one (CAS 119385-97-6) is a chemical compound with molecular formula C12H8N2O3S and molecular weight 260.02557 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-amino-1,3-thiazol-4-yl)-7-hydroxychromen-2-one
Also Known As: 3-(2-aminothiazol-4-yl)-7-hydroxy-2H-chromen-2-one, 2H-Cromen-2-one, 3-(2-amino-4-thiazolyl)-7-hydroxy-, 3-(2-amino-1,3-thiazol-4-yl)-7-hydroxychromen-2-one, 3-(2-Amino-1,3-thiazol-4-yl)-7-hydroxy-2H-chromen-2-one, 3-(2-Amino-1,3-thiazol-4-yl)-7-hydroxy-2H-chromen-2-one #
| Molecular Formula | C12H8N2O3S |
| Molecular Weight | 260.02557 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 114.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 260.02557 Da |
| Heavy Atoms | 18 |
| Complexity | 388.0 |
| SMILES | C1=CC2=C(C=C1O)OC(=O)C(=C2)C3=CSC(=N3)N |
| InChIKey | DLNIJBXAQKNZNI-UHFFFAOYSA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-aminothiazol-4-yl)-7-hydroxy-2H-chromen-2-one. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-aminothiazol-4-yl)-7-hydroxy-2H-chromen-2-one. Following Lipinski's Rule of Five, 3-(2-aminothiazol-4-yl)-7-hydroxy-2H-chromen-2-one has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-(2-aminothiazol-4-yl)-7-hydroxy-2H-chromen-2-one is 119385-97-6.
The molecular formula of 3-(2-aminothiazol-4-yl)-7-hydroxy-2H-chromen-2-one is C12H8N2O3S.
The molecular weight of 3-(2-aminothiazol-4-yl)-7-hydroxy-2H-chromen-2-one is 260.02557 g/mol.
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