TL;DR: 3-(3-Methoxybenzyl)-7-thia-1,3-diazaspiro[4.4]nonane-2,4-dione (CAS 1351369-16-8) is a chemical compound with molecular formula C14H16N2O3S and molecular weight 292.08817 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(3-methoxyphenyl)methyl]-7-thia-1,3-diazaspiro[4.4]nonane-2,4-dione
Also Known As: 3-(3-Methoxybenzyl)-7-thia-1,3-diazaspiro[4.4]nonane-2,4-dione, 7-[(3-methoxyphenyl)methyl]-3-thia-7,9-diazaspiro[4.4]nonane-6,8-dione
| Molecular Formula | C14H16N2O3S |
| Molecular Weight | 292.08817 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 83.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 292.08817 Da |
| Heavy Atoms | 20 |
| Complexity | 417.0 |
| SMILES | COC1=CC=CC(=C1)CN2C(=O)C3(CCSC3)NC2=O |
| InChIKey | UEDXTWHMTZDPDR-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-Methoxybenzyl)-7-thia-1,3-diazaspiro[4.4]nonane-2,4-dione. The TPSA of 83.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-Methoxybenzyl)-7-thia-1,3-diazaspiro[4.4]nonane-2,4-dione. Following Lipinski's Rule of Five, 3-(3-Methoxybenzyl)-7-thia-1,3-diazaspiro[4.4]nonane-2,4-dione 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 3-(3-Methoxybenzyl)-7-thia-1,3-diazaspiro[4.4]nonane-2,4-dione is 1351369-16-8.
The molecular formula of 3-(3-Methoxybenzyl)-7-thia-1,3-diazaspiro[4.4]nonane-2,4-dione is C14H16N2O3S.
The molecular weight of 3-(3-Methoxybenzyl)-7-thia-1,3-diazaspiro[4.4]nonane-2,4-dione is 292.08817 g/mol.
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