TL;DR: 2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)-N-(propan-2-yl)benzamide (CAS 1011957-47-3) is a chemical compound with molecular formula C14H19ClN2O3S and molecular weight 330.0805 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-4-(1,1-dioxothiazinan-2-yl)-N-propan-2-ylbenzamide
Also Known As: 2-chloro-4-(1,1-dioxothiazinan-2-yl)-N-propan-2-ylbenzamide, 2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)-N-isopropylbenzamide, 2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)-N-(propan-2-yl)benzamide
| Molecular Formula | C14H19ClN2O3S |
| Molecular Weight | 330.0805 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.0805 Da |
| Heavy Atoms | 21 |
| Complexity | 475.0 |
| SMILES | CC(C)NC(=O)C1=C(C=C(C=C1)N2CCCCS2(=O)=O)Cl |
| InChIKey | JMBZJVIPDAETFI-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)-N-(propan-2-yl)benzamide. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)-N-(propan-2-yl)benzamide. Following Lipinski's Rule of Five, 2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)-N-(propan-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 2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)-N-(propan-2-yl)benzamide is 1011957-47-3.
The molecular formula of 2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)-N-(propan-2-yl)benzamide is C14H19ClN2O3S.
The molecular weight of 2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)-N-(propan-2-yl)benzamide is 330.0805 g/mol.
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