4-((4-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl)sulfonyl)morpholine
TL;DR: 4-((4-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl)sulfonyl)morpholine (CAS 749918-35-2) is a chemical compound with molecular formula C21H25N3O7S and molecular weight 463.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-nitrophenyl]sulfonylmorpholine
Also Known As: 4-((4-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl)sulfonyl)morpholine, 4-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-nitrophenyl]sulfonylmorpholine, 6,7-dimethoxy-2-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)-3,4-dihydro-1H-isoquinoline, 6,7-dimethoxy-2-[4-(morpholin-4-ylsulfonyl)-2-nitrophenyl]-1,2,3,4-tetrahydroisoquinoline
| Molecular Formula | C21H25N3O7S |
|---|---|
| Molecular Weight | 463.14 g/mol |
| LogP | 2.1956 |
| Topological Polar Surface Area | 111.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 463.14133 |
| Heavy Atoms | 32 |
| Complexity | 1130.4535 |
Chemical Identifiers
| CAS Number | 749918-35-2 |
|---|---|
| SMILES | COC1=C(C=C2CN(CCC2=C1)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-])OC |
Product Overview
4-((4-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl)sulfonyl)morpholine (CAS 749918-35-2), with molecular formula C21H25N3O7S and molecular weight 463.14 g/mol. IUPAC: 4-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-nitrophenyl]sulfonylmorpholine.
Chemical Property Profile of 4-((4-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl)sulfonyl)morpholine
Property Insights of 4-((4-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl)sulfonyl)morpholine
The XLogP value of 2.1956 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((4-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl)sulfonyl)morpholine. The TPSA of 111.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((4-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl)sulfonyl)morpholine. Following Lipinski's Rule of Five, 4-((4-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl)sulfonyl)morpholine has 0 hydrogen bond donor(s) and 8 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 4-((4-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl)sulfonyl)morpholine?
The CAS number of 4-((4-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl)sulfonyl)morpholine is 749918-35-2.
What is the molecular formula of 4-((4-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl)sulfonyl)morpholine?
The molecular formula of 4-((4-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl)sulfonyl)morpholine is C21H25N3O7S.
What is the molecular weight of 4-((4-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl)sulfonyl)morpholine?
The molecular weight of 4-((4-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl)sulfonyl)morpholine is 463.14 g/mol.
Where can I buy 4-((4-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl)sulfonyl)morpholine?
You can request a quote for 4-((4-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl)sulfonyl)morpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((4-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl)sulfonyl)morpholine?
Yes, KEHONG BIO provides custom synthesis services for 4-((4-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-3-nitrophenyl)sulfonyl)morpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.