TL;DR: 3-(1,1-dioxido-1,2-thiazinan-2-yl)-N-(2-methylpropyl)benzamide (CAS 1011704-22-5) is a chemical compound with molecular formula C15H22N2O3S and molecular weight 310.1351 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(1,1-dioxothiazinan-2-yl)-N-(2-methylpropyl)benzamide
Also Known As: 3-(1,1-dioxido-1,2-thiazinan-2-yl)-N-isobutylbenzamide, 3-(1,1-dioxothiazinan-2-yl)-N-(2-methylpropyl)benzamide, 3-(1,1-dioxido-1,2-thiazinan-2-yl)-N-(2-methylpropyl)benzamide
| Molecular Formula | C15H22N2O3S |
| Molecular Weight | 310.1351 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 310.1351 Da |
| Heavy Atoms | 21 |
| Complexity | 456.0 |
| SMILES | CC(C)CNC(=O)C1=CC(=CC=C1)N2CCCCS2(=O)=O |
| InChIKey | REQDNCVBZHXBJG-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1,1-dioxido-1,2-thiazinan-2-yl)-N-(2-methylpropyl)benzamide. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1,1-dioxido-1,2-thiazinan-2-yl)-N-(2-methylpropyl)benzamide. Following Lipinski's Rule of Five, 3-(1,1-dioxido-1,2-thiazinan-2-yl)-N-(2-methylpropyl)benzamide 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-(1,1-dioxido-1,2-thiazinan-2-yl)-N-(2-methylpropyl)benzamide is 1011704-22-5.
The molecular formula of 3-(1,1-dioxido-1,2-thiazinan-2-yl)-N-(2-methylpropyl)benzamide is C15H22N2O3S.
The molecular weight of 3-(1,1-dioxido-1,2-thiazinan-2-yl)-N-(2-methylpropyl)benzamide is 310.1351 g/mol.
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