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 370.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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
| Molecular Formula | C17H23ClN2O3S |
|---|---|
| Molecular Weight | 370.11 g/mol |
| LogP | 3.2862 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 370.1118 |
| Heavy Atoms | 24 |
| Complexity | 712.5459 |
Chemical Identifiers
| CAS Number | 1011653-48-7 |
|---|---|
| SMILES | C1CCCN(CC1)C(=O)C2=C(C=C(C=C2)N3CCCCS3(=O)=O)Cl |
Product Overview
Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone (CAS 1011653-48-7), with molecular formula C17H23ClN2O3S and molecular weight 370.11 g/mol. IUPAC: azepan-1-yl-[2-chloro-4-(1,1-dioxothiazinan-2-yl)phenyl]methanone.
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 3.2862 indicates that Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.69 Ų, Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. 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 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
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 370.11 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 KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Azepan-1-yl(2-chloro-4-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl)methanone?
Yes, KEHONG BIO 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.