8-(4-Methoxybenzene-1-sulfonyl)-1-methyl-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridine
TL;DR: 8-(4-Methoxybenzene-1-sulfonyl)-1-methyl-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridine (CAS 7063-12-9) is a chemical compound with molecular formula C19H22N2O3S and molecular weight 358.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-(4-methoxyphenyl)sulfonyl-2-methyl-2,11-diazatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene
Also Known As: 8-(4-Methoxybenzene-1-sulfonyl)-1-methyl-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridine
| Molecular Formula | C19H22N2O3S |
|---|---|
| Molecular Weight | 358.14 g/mol |
| LogP | 2.4287 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 358.1351 |
| Heavy Atoms | 25 |
| Complexity | 893.38525 |
Chemical Identifiers
| CAS Number | 7063-12-9 |
|---|---|
| SMILES | CN1CCC2=C3C1CN(CC3=CC=C2)S(=O)(=O)C4=CC=C(C=C4)OC |
Product Overview
8-(4-Methoxybenzene-1-sulfonyl)-1-methyl-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridine (CAS 7063-12-9), with molecular formula C19H22N2O3S and molecular weight 358.14 g/mol. IUPAC: 11-(4-methoxyphenyl)sulfonyl-2-methyl-2,11-diazatricyclo[7.3.1.05,13]trideca-5(13),6,8-triene.
Chemical Property Profile of 8-(4-Methoxybenzene-1-sulfonyl)-1-methyl-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridine
Property Insights of 8-(4-Methoxybenzene-1-sulfonyl)-1-methyl-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridine
The XLogP value of 2.4287 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-(4-Methoxybenzene-1-sulfonyl)-1-methyl-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridine. With a topological polar surface area (TPSA) of 49.85 Ų, 8-(4-Methoxybenzene-1-sulfonyl)-1-methyl-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-(4-Methoxybenzene-1-sulfonyl)-1-methyl-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridine 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
Frequently Asked Questions
What is the CAS number of 8-(4-Methoxybenzene-1-sulfonyl)-1-methyl-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridine?
The CAS number of 8-(4-Methoxybenzene-1-sulfonyl)-1-methyl-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridine is 7063-12-9.
What is the molecular formula of 8-(4-Methoxybenzene-1-sulfonyl)-1-methyl-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridine?
The molecular formula of 8-(4-Methoxybenzene-1-sulfonyl)-1-methyl-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridine is C19H22N2O3S.
What is the molecular weight of 8-(4-Methoxybenzene-1-sulfonyl)-1-methyl-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridine?
The molecular weight of 8-(4-Methoxybenzene-1-sulfonyl)-1-methyl-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridine is 358.14 g/mol.
Where can I buy 8-(4-Methoxybenzene-1-sulfonyl)-1-methyl-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridine?
You can request a quote for 8-(4-Methoxybenzene-1-sulfonyl)-1-methyl-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-(4-Methoxybenzene-1-sulfonyl)-1-methyl-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridine?
Yes, KEHONG BIO provides custom synthesis services for 8-(4-Methoxybenzene-1-sulfonyl)-1-methyl-2,3,7,8,9,9a-hexahydro-1H-benzo[de][1,7]naphthyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.