(tetrahydrofuran-2-yl)methyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
TL;DR: (tetrahydrofuran-2-yl)methyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate (CAS 1005268-66-5) is a chemical compound with molecular formula C28H30BrNO7 and molecular weight 571.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxolan-2-ylmethyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: (tetrahydrofuran-2-yl)methyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, oxolan-2-ylmethyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(2-furyl)-2-methyl-5-oxo-1 ,4,6,7,8-pentahydroquinoline-3-carboxylate, oxolan-2-ylmethyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, tetrahydrofuran-2-ylmethyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
| Molecular Formula | C28H30BrNO7 |
|---|---|
| Molecular Weight | 571.12 g/mol |
| LogP | 5.1431 |
| Topological Polar Surface Area | 96.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 571.12054 |
| Heavy Atoms | 37 |
| Complexity | 1257.5684 |
Chemical Identifiers
| CAS Number | 1005268-66-5 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CO3)C4=CC(=C(C=C4OC)Br)OC)C(=O)OCC5CCCO5 |
Product Overview
(tetrahydrofuran-2-yl)methyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate (CAS 1005268-66-5), with molecular formula C28H30BrNO7 and molecular weight 571.12 g/mol. IUPAC: oxolan-2-ylmethyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of (tetrahydrofuran-2-yl)methyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Property Insights of (tetrahydrofuran-2-yl)methyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
The XLogP value of 5.1431 indicates that (tetrahydrofuran-2-yl)methyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.23 Ų falls within the moderate polarity range, balancing permeability and solubility for (tetrahydrofuran-2-yl)methyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate. Following Lipinski's Rule of Five, (tetrahydrofuran-2-yl)methyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (tetrahydrofuran-2-yl)methyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate?
The CAS number of (tetrahydrofuran-2-yl)methyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate is 1005268-66-5.
What is the molecular formula of (tetrahydrofuran-2-yl)methyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate?
The molecular formula of (tetrahydrofuran-2-yl)methyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate is C28H30BrNO7.
What is the molecular weight of (tetrahydrofuran-2-yl)methyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate?
The molecular weight of (tetrahydrofuran-2-yl)methyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate is 571.12 g/mol.
Where can I buy (tetrahydrofuran-2-yl)methyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate?
You can request a quote for (tetrahydrofuran-2-yl)methyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (tetrahydrofuran-2-yl)methyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (tetrahydrofuran-2-yl)methyl 4-(4-bromo-2,5-dimethoxyphenyl)-7-(furan-2-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.