![2-phenyl-N-{7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraen-12-yl}ethene-1-sulfonamide structure](/static/products/854/854136-94-0.png)
2-phenyl-N-{7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraen-12-yl}ethene-1-sulfonamide
TL;DR: 2-phenyl-N-{7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraen-12-yl}ethene-1-sulfonamide (CAS 854136-94-0) is a chemical compound with molecular formula C17H15N3O2S2 and molecular weight 357.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-phenyl-N-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-yl)ethenesulfonamide
Also Known As: 2-phenyl-N-{7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraen-12-yl}ethene-1-sulfonamide
| Molecular Formula | C17H15N3O2S2 |
|---|---|
| Molecular Weight | 357.06 g/mol |
| LogP | 3.5926 |
| Topological Polar Surface Area | 71.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 357.06058 |
| Heavy Atoms | 24 |
| Complexity | 1024.6752 |
Chemical Identifiers
| CAS Number | 854136-94-0 |
|---|---|
| SMILES | C1CC2=C(C1)SC3=NC=NC(=C23)NS(=O)(=O)/C=C/C4=CC=CC=C4 |
Product Overview
2-phenyl-N-{7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraen-12-yl}ethene-1-sulfonamide (CAS 854136-94-0), with molecular formula C17H15N3O2S2 and molecular weight 357.06 g/mol. IUPAC: (E)-2-phenyl-N-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-yl)ethenesulfonamide.
Chemical Property Profile of 2-phenyl-N-{7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraen-12-yl}ethene-1-sulfonamide
Property Insights of 2-phenyl-N-{7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraen-12-yl}ethene-1-sulfonamide
The XLogP value of 3.5926 indicates that 2-phenyl-N-{7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraen-12-yl}ethene-1-sulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.95 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-phenyl-N-{7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraen-12-yl}ethene-1-sulfonamide. Following Lipinski's Rule of Five, 2-phenyl-N-{7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraen-12-yl}ethene-1-sulfonamide has 1 hydrogen bond donor(s) and 5 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 2-phenyl-N-{7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraen-12-yl}ethene-1-sulfonamide?
The CAS number of 2-phenyl-N-{7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraen-12-yl}ethene-1-sulfonamide is 854136-94-0.
What is the molecular formula of 2-phenyl-N-{7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraen-12-yl}ethene-1-sulfonamide?
The molecular formula of 2-phenyl-N-{7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraen-12-yl}ethene-1-sulfonamide is C17H15N3O2S2.
What is the molecular weight of 2-phenyl-N-{7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraen-12-yl}ethene-1-sulfonamide?
The molecular weight of 2-phenyl-N-{7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraen-12-yl}ethene-1-sulfonamide is 357.06 g/mol.
Where can I buy 2-phenyl-N-{7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraen-12-yl}ethene-1-sulfonamide?
You can request a quote for 2-phenyl-N-{7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraen-12-yl}ethene-1-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-phenyl-N-{7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraen-12-yl}ethene-1-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 2-phenyl-N-{7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraen-12-yl}ethene-1-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.