TL;DR: [4-chloro-3-(1,1-dioxothiazinan-2-yl)phenyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone (CAS 1011882-68-0) is a chemical compound with molecular formula C20H21ClN2O3S and molecular weight 404.09613 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-chloro-3-(1,1-dioxothiazinan-2-yl)phenyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone
Also Known As: [4-chloro-3-(1,1-dioxothiazinan-2-yl)phenyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone|(4-chloro-3-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)(3,4-dihydroquinolin-1(2H)-yl)methanone|[4-chloro-3-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl](3,4-dihydroquinolin-1(2H)-yl)methanone|STK648322
| Molecular Formula | C20H21ClN2O3S |
| Molecular Weight | 404.09613 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 66.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 404.09613 Da |
| Heavy Atoms | 27 |
| Complexity | 650.0 |
| SMILES | C1CCS(=O)(=O)N(C1)C2=C(C=CC(=C2)C(=O)N3CCCC4=CC=CC=C43)Cl |
| InChIKey | DCGDAMIQJPIEDZ-UHFFFAOYSA-N |
The XLogP value of 3.6 indicates that [4-chloro-3-(1,1-dioxothiazinan-2-yl)phenyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-chloro-3-(1,1-dioxothiazinan-2-yl)phenyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone. Following Lipinski's Rule of Five, [4-chloro-3-(1,1-dioxothiazinan-2-yl)phenyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone has 0 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 [4-chloro-3-(1,1-dioxothiazinan-2-yl)phenyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone is 1011882-68-0.
The molecular formula of [4-chloro-3-(1,1-dioxothiazinan-2-yl)phenyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone is C20H21ClN2O3S.
The molecular weight of [4-chloro-3-(1,1-dioxothiazinan-2-yl)phenyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone is 404.09613 g/mol.
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