Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone
TL;DR: Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone (CAS 1011653-48-7) is a chemical compound with molecular formula C17H23ClN2O3S and molecular weight 370.1118 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
azepan-1-yl-[2-chloro-4-(1,1-dioxothiazinan-2-yl)phenyl]methanone
Also Known As: azepan-1-yl-[2-chloro-4-(1,1-dioxothiazinan-2-yl)phenyl]methanone, azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone, azepan-1-yl[2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl]methanone
Technical Specifications
| Molecular Formula | C17H23ClN2O3S |
| Molecular Weight | 370.1118 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 66.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 370.1118 Da |
| Heavy Atoms | 24 |
| Complexity | 541.0 |
| SMILES | C1CCCN(CC1)C(=O)C2=C(C=C(C=C2)N3CCCCS3(=O)=O)Cl |
| InChIKey | WZWTVEZCBOKEAU-UHFFFAOYSA-N |
Chemical Property Profile of Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone
Property Insights of Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone. Following Lipinski's Rule of Five, Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone?
The CAS number of Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone is 1011653-48-7.
What is the molecular formula of Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone?
The molecular formula of Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone is C17H23ClN2O3S.
What is the molecular weight of Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone?
The molecular weight of Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone is 370.1118 g/mol.
Where can I buy Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone?
You can request a quote for Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone?
Yes, CoreyChem provides custom synthesis services for Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.