AB00037746-01
TL;DR: AB00037746-01 (CAS 340801-79-8) is a chemical compound with molecular formula C18H20FNO4S and molecular weight 365.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-fluorophenyl)sulfonyl-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinoline
Also Known As: AB00037746-01, AO-022/43389495, 2-[(4-fluorophenyl)sulfonyl]-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline, 2-((4-fluorophenyl)sulfonyl)-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline, 2-(4-fluorophenyl)sulfonyl-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinoline
| Molecular Formula | C18H20FNO4S |
|---|---|
| Molecular Weight | 365.11 g/mol |
| LogP | 3.1509 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 365.1097 |
| Heavy Atoms | 25 |
| Complexity | 880.6942 |
Chemical Identifiers
| CAS Number | 340801-79-8 |
|---|---|
| SMILES | CC1C2=CC(=C(C=C2CCN1S(=O)(=O)C3=CC=C(C=C3)F)OC)OC |
Product Overview
AB00037746-01 (CAS 340801-79-8), with molecular formula C18H20FNO4S and molecular weight 365.11 g/mol. IUPAC: 2-(4-fluorophenyl)sulfonyl-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinoline.
Chemical Property Profile of AB00037746-01
Property Insights of AB00037746-01
The XLogP value of 3.1509 indicates that AB00037746-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.84 Ų, AB00037746-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00037746-01 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 AB00037746-01?
The CAS number of AB00037746-01 is 340801-79-8.
What is the molecular formula of AB00037746-01?
The molecular formula of AB00037746-01 is C18H20FNO4S.
What is the molecular weight of AB00037746-01?
The molecular weight of AB00037746-01 is 365.11 g/mol.
Where can I buy AB00037746-01?
You can request a quote for AB00037746-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00037746-01?
Yes, KEHONG BIO provides custom synthesis services for AB00037746-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.