1,3,3a,4,9,9a-Hexahydro-4-(4-chlorobenzoyl)thieno(3,4-b)quinoxaline 2,2-dioxide
TL;DR: 1,3,3a,4,9,9a-Hexahydro-4-(4-chlorobenzoyl)thieno(3,4-b)quinoxaline 2,2-dioxide (CAS 129303-28-2) is a chemical compound with molecular formula C17H15ClN2O3S and molecular weight 362.0492 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(3aR,9aS)-2,2-dioxo-3,3a,9,9a-tetrahydro-1H-thieno[3,4-b]quinoxalin-4-yl]-(4-chlorophenyl)methanone
Also Known As: 1,3,3a,4,9,9a-Hexahydro-4-(4-chlorobenzoyl)thieno(3,4-b)quinoxaline 2,2-dioxide, 4-(4-Chlorobenzoyl)-1,3,3a,4,9,9a-hexahydrothieno(3,4-b)quinoxaline 2,2-dioxide, Parachlorobenzoyl-4 hexahydro-1,3,3a,4,9,9a thieno(3,4-b)quinoxaline dioxyde-2,2 [French], Thieno(3,4-b)quinoxaline, 1,3,3a,4,9,9a-hexahydro-4-(4-chlorobenzoyl)-, 2-oxide, cis-, Parachlorobenzoyl-4 hexahydro-1,3,3a,4,9,9a thieno(3,4-b)quinoxaline dioxyde-2,2
Technical Specifications
| Molecular Formula | C17H15ClN2O3S |
| Molecular Weight | 362.0492 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 362.0492 Da |
| Heavy Atoms | 24 |
| Complexity | 597.0 |
| SMILES | C1[C@@H]2[C@H](CS1(=O)=O)N(C3=CC=CC=C3N2)C(=O)C4=CC=C(C=C4)Cl |
| InChIKey | NIDUBXPZSRHJBS-ZBFHGGJFSA-N |
Chemical Property Profile of 1,3,3a,4,9,9a-Hexahydro-4-(4-chlorobenzoyl)thieno(3,4-b)quinoxaline 2,2-dioxide
Property Insights of 1,3,3a,4,9,9a-Hexahydro-4-(4-chlorobenzoyl)thieno(3,4-b)quinoxaline 2,2-dioxide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,3a,4,9,9a-Hexahydro-4-(4-chlorobenzoyl)thieno(3,4-b)quinoxaline 2,2-dioxide. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,3a,4,9,9a-Hexahydro-4-(4-chlorobenzoyl)thieno(3,4-b)quinoxaline 2,2-dioxide. Following Lipinski's Rule of Five, 1,3,3a,4,9,9a-Hexahydro-4-(4-chlorobenzoyl)thieno(3,4-b)quinoxaline 2,2-dioxide 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
What is the CAS number of 1,3,3a,4,9,9a-Hexahydro-4-(4-chlorobenzoyl)thieno(3,4-b)quinoxaline 2,2-dioxide?
The CAS number of 1,3,3a,4,9,9a-Hexahydro-4-(4-chlorobenzoyl)thieno(3,4-b)quinoxaline 2,2-dioxide is 129303-28-2.
What is the molecular formula of 1,3,3a,4,9,9a-Hexahydro-4-(4-chlorobenzoyl)thieno(3,4-b)quinoxaline 2,2-dioxide?
The molecular formula of 1,3,3a,4,9,9a-Hexahydro-4-(4-chlorobenzoyl)thieno(3,4-b)quinoxaline 2,2-dioxide is C17H15ClN2O3S.
What is the molecular weight of 1,3,3a,4,9,9a-Hexahydro-4-(4-chlorobenzoyl)thieno(3,4-b)quinoxaline 2,2-dioxide?
The molecular weight of 1,3,3a,4,9,9a-Hexahydro-4-(4-chlorobenzoyl)thieno(3,4-b)quinoxaline 2,2-dioxide is 362.0492 g/mol.
Where can I buy 1,3,3a,4,9,9a-Hexahydro-4-(4-chlorobenzoyl)thieno(3,4-b)quinoxaline 2,2-dioxide?
You can request a quote for 1,3,3a,4,9,9a-Hexahydro-4-(4-chlorobenzoyl)thieno(3,4-b)quinoxaline 2,2-dioxide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3,3a,4,9,9a-Hexahydro-4-(4-chlorobenzoyl)thieno(3,4-b)quinoxaline 2,2-dioxide?
Yes, CoreyChem provides custom synthesis services for 1,3,3a,4,9,9a-Hexahydro-4-(4-chlorobenzoyl)thieno(3,4-b)quinoxaline 2,2-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.