TL;DR: 1-[4-chloro-3-(1,1-dioxothiazinan-2-yl)benzoyl]piperidine-4-carboxamide (CAS 1011654-19-5) is a chemical compound with molecular formula C17H22ClN3O4S and molecular weight 399.10196 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[4-chloro-3-(1,1-dioxothiazinan-2-yl)benzoyl]piperidine-4-carboxamide
Also Known As: 1-[4-chloro-3-(1,1-dioxothiazinan-2-yl)benzoyl]piperidine-4-carboxamide, 1-(4-chloro-3-(1,1-dioxido-1,2-thiazinan-2-yl)benzoyl)piperidine-4-carboxamide, 1-{[4-chloro-3-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl]carbonyl}piperidine-4-carboxamide
| Molecular Formula | C17H22ClN3O4S |
| Molecular Weight | 399.10196 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 109.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 399.10196 Da |
| Heavy Atoms | 26 |
| Complexity | 643.0 |
| SMILES | C1CCS(=O)(=O)N(C1)C2=C(C=CC(=C2)C(=O)N3CCC(CC3)C(=O)N)Cl |
| InChIKey | OKOYMDTUMXNHTK-UHFFFAOYSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[4-chloro-3-(1,1-dioxothiazinan-2-yl)benzoyl]piperidine-4-carboxamide. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[4-chloro-3-(1,1-dioxothiazinan-2-yl)benzoyl]piperidine-4-carboxamide. Following Lipinski's Rule of Five, 1-[4-chloro-3-(1,1-dioxothiazinan-2-yl)benzoyl]piperidine-4-carboxamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-[4-chloro-3-(1,1-dioxothiazinan-2-yl)benzoyl]piperidine-4-carboxamide is 1011654-19-5.
The molecular formula of 1-[4-chloro-3-(1,1-dioxothiazinan-2-yl)benzoyl]piperidine-4-carboxamide is C17H22ClN3O4S.
The molecular weight of 1-[4-chloro-3-(1,1-dioxothiazinan-2-yl)benzoyl]piperidine-4-carboxamide is 399.10196 g/mol.
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