N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide
TL;DR: N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide (CAS 941992-52-5) is a chemical compound with molecular formula C18H17N3O3S and molecular weight 355.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide
Also Known As: VU0498370-1, N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide, F2781-0050, N-(2-cyanophenyl)-4-(1,1-dioxido-1,2-thiazinan-2-yl)benzamide, N-(2-cyanophenyl)-4-(1,1-dioxo-1lambda6,2-thiazinan-2-yl)benzamide
| Molecular Formula | C18H17N3O3S |
|---|---|
| Molecular Weight | 355.10 g/mol |
| LogP | 2.74058 |
| Topological Polar Surface Area | 90.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 355.09906 |
| Heavy Atoms | 25 |
| Complexity | 930.7838 |
Chemical Identifiers
| CAS Number | 941992-52-5 |
|---|---|
| SMILES | C1CCS(=O)(=O)N(C1)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C#N |
Product Overview
N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide (CAS 941992-52-5), with molecular formula C18H17N3O3S and molecular weight 355.10 g/mol. IUPAC: N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide.
Chemical Property Profile of N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide
Property Insights of N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide
The XLogP value of 2.74058 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide. The TPSA of 90.27 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide. Following Lipinski's Rule of Five, N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-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.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide?
The CAS number of N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide is 941992-52-5.
What is the molecular formula of N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide?
The molecular formula of N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide is C18H17N3O3S.
What is the molecular weight of N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide?
The molecular weight of N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide is 355.10 g/mol.
Where can I buy N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide?
You can request a quote for N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-cyanophenyl)-4-(1,1-dioxothiazinan-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.