TL;DR: N-(4-bromophenyl)-4-(1,1-dioxido-1,2-thiazinan-2-yl)benzamide (CAS 1005300-85-5) is a chemical compound with molecular formula C17H17BrN2O3S and molecular weight 408.01434 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-bromophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide
Also Known As: N-(4-bromophenyl)-4-(1,1-dioxido-1,2-thiazinan-2-yl)benzamide, N-(4-bromophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide, F2044-0002, N-(4-bromophenyl)-4-(1,1-dioxo-1lambda6,2-thiazinan-2-yl)benzamide
| Molecular Formula | C17H17BrN2O3S |
| Molecular Weight | 408.01434 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 408.01434 Da |
| Heavy Atoms | 24 |
| Complexity | 533.0 |
| SMILES | C1CCS(=O)(=O)N(C1)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)Br |
| InChIKey | LCTVLNSSOHZYIU-UHFFFAOYSA-N |
The XLogP value of 3.1 indicates that N-(4-bromophenyl)-4-(1,1-dioxido-1,2-thiazinan-2-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-bromophenyl)-4-(1,1-dioxido-1,2-thiazinan-2-yl)benzamide. Following Lipinski's Rule of Five, N-(4-bromophenyl)-4-(1,1-dioxido-1,2-thiazinan-2-yl)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 N-(4-bromophenyl)-4-(1,1-dioxido-1,2-thiazinan-2-yl)benzamide is 1005300-85-5.
The molecular formula of N-(4-bromophenyl)-4-(1,1-dioxido-1,2-thiazinan-2-yl)benzamide is C17H17BrN2O3S.
The molecular weight of N-(4-bromophenyl)-4-(1,1-dioxido-1,2-thiazinan-2-yl)benzamide is 408.01434 g/mol.
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