A3161/0133755
TL;DR: A3161/0133755 (CAS 524002-03-7) is a chemical compound with molecular formula C26H29NO6 and molecular weight 451.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 7-(4-ethoxy-3-methoxyphenyl)-2-methyl-4-(5-methylfuran-2-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: A3161/0133755, methyl 7-(4-ethoxy-3-methoxyphenyl)-2-methyl-4-(5-methylfuran-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, methyl 7-(4-ethoxy-3-methoxyphenyl)-2-methyl-4-(5-methylfuran-2-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
| Molecular Formula | C26H29NO6 |
|---|---|
| Molecular Weight | 451.20 g/mol |
| LogP | 4.52992 |
| Topological Polar Surface Area | 87.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 451.1995 |
| Heavy Atoms | 33 |
| Complexity | 1155.282 |
Chemical Identifiers
| CAS Number | 524002-03-7 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C2CC3=C(C(C(=C(N3)C)C(=O)OC)C4=CC=C(O4)C)C(=O)C2)OC |
Product Overview
A3161/0133755 (CAS 524002-03-7), with molecular formula C26H29NO6 and molecular weight 451.20 g/mol. IUPAC: methyl 7-(4-ethoxy-3-methoxyphenyl)-2-methyl-4-(5-methylfuran-2-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of A3161/0133755
Property Insights of A3161/0133755
The XLogP value of 4.52992 indicates that A3161/0133755 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for A3161/0133755. Following Lipinski's Rule of Five, A3161/0133755 has 1 hydrogen bond donor(s) and 7 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 A3161/0133755?
The CAS number of A3161/0133755 is 524002-03-7.
What is the molecular formula of A3161/0133755?
The molecular formula of A3161/0133755 is C26H29NO6.
What is the molecular weight of A3161/0133755?
The molecular weight of A3161/0133755 is 451.20 g/mol.
Where can I buy A3161/0133755?
You can request a quote for A3161/0133755 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3161/0133755?
Yes, KEHONG BIO provides custom synthesis services for A3161/0133755 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.