4a-Chloro-2-(2-furoyl)-1-phenyldecahydroisoquinoline
TL;DR: 4a-Chloro-2-(2-furoyl)-1-phenyldecahydroisoquinoline (CAS 1005142-19-7) is a chemical compound with molecular formula C20H22ClNO2 and molecular weight 343.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4a-chloro-1-phenyl-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl)-(furan-2-yl)methanone
Also Known As: 4a-chloro-2-(2-furoyl)-1-phenyldecahydroisoquinoline, AS-871/42853855, 4a-chloro-2-(furan-2-carbonyl)-1-phenyl-decahydroisoquinoline, (4a-chloro-1-phenyl-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl)-(furan-2-yl)methanone, 6-chloro-2-phenyl-3-azabicyclo[4.4.0]dec-3-yl 2-furyl ketone
| Molecular Formula | C20H22ClNO2 |
|---|---|
| Molecular Weight | 343.13 g/mol |
| LogP | 5.0346 |
| Topological Polar Surface Area | 33.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 343.1339 |
| Heavy Atoms | 24 |
| Complexity | 699.6936 |
Chemical Identifiers
| CAS Number | 1005142-19-7 |
|---|---|
| SMILES | C1CCC2(CCN(C(C2C1)C3=CC=CC=C3)C(=O)C4=CC=CO4)Cl |
Product Overview
4a-Chloro-2-(2-furoyl)-1-phenyldecahydroisoquinoline (CAS 1005142-19-7), with molecular formula C20H22ClNO2 and molecular weight 343.13 g/mol. IUPAC: (4a-chloro-1-phenyl-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl)-(furan-2-yl)methanone.
Chemical Property Profile of 4a-Chloro-2-(2-furoyl)-1-phenyldecahydroisoquinoline
Property Insights of 4a-Chloro-2-(2-furoyl)-1-phenyldecahydroisoquinoline
The XLogP value of 5.0346 indicates that 4a-Chloro-2-(2-furoyl)-1-phenyldecahydroisoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.45 Ų, 4a-Chloro-2-(2-furoyl)-1-phenyldecahydroisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4a-Chloro-2-(2-furoyl)-1-phenyldecahydroisoquinoline has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4a-Chloro-2-(2-furoyl)-1-phenyldecahydroisoquinoline?
The CAS number of 4a-Chloro-2-(2-furoyl)-1-phenyldecahydroisoquinoline is 1005142-19-7.
What is the molecular formula of 4a-Chloro-2-(2-furoyl)-1-phenyldecahydroisoquinoline?
The molecular formula of 4a-Chloro-2-(2-furoyl)-1-phenyldecahydroisoquinoline is C20H22ClNO2.
What is the molecular weight of 4a-Chloro-2-(2-furoyl)-1-phenyldecahydroisoquinoline?
The molecular weight of 4a-Chloro-2-(2-furoyl)-1-phenyldecahydroisoquinoline is 343.13 g/mol.
Where can I buy 4a-Chloro-2-(2-furoyl)-1-phenyldecahydroisoquinoline?
You can request a quote for 4a-Chloro-2-(2-furoyl)-1-phenyldecahydroisoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4a-Chloro-2-(2-furoyl)-1-phenyldecahydroisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 4a-Chloro-2-(2-furoyl)-1-phenyldecahydroisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.