BAS 03363591
TL;DR: BAS 03363591 (CAS 346716-82-3) is a chemical compound with molecular formula C21H27NO4 and molecular weight 357.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 2,7,7-trimethyl-4-(5-methylfuran-2-yl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: BAS 03363591, A2552/0108688, propyl 2,7,7-trimethyl-4-(5-methyl(2-furyl))-5-oxo-1,4,6,7,8-pentahydroquinoli ne-3-carboxylate, propyl 2,7,7-trimethyl-4-(5-methylfuran-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, PROPYL 2,7,7-TRIMETHYL-4-(5-METHYL-2-FURYL)-5-OXO-1,4,5,6,7,8-HEXAHYDRO-3-QUINOLINECARBOXYLATE
| Molecular Formula | C21H27NO4 |
|---|---|
| Molecular Weight | 357.19 g/mol |
| LogP | 4.14522 |
| Topological Polar Surface Area | 68.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 357.194 |
| Heavy Atoms | 26 |
| Complexity | 809.73236 |
Chemical Identifiers
| CAS Number | 346716-82-3 |
|---|---|
| SMILES | CCCOC(=O)C1=C(NC2=C(C1C3=CC=C(O3)C)C(=O)CC(C2)(C)C)C |
Product Overview
BAS 03363591 (CAS 346716-82-3), with molecular formula C21H27NO4 and molecular weight 357.19 g/mol. IUPAC: propyl 2,7,7-trimethyl-4-(5-methylfuran-2-yl)-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of BAS 03363591
Property Insights of BAS 03363591
The XLogP value of 4.14522 indicates that BAS 03363591 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.54 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03363591. Following Lipinski's Rule of Five, BAS 03363591 has 1 hydrogen bond donor(s) and 5 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 BAS 03363591?
The CAS number of BAS 03363591 is 346716-82-3.
What is the molecular formula of BAS 03363591?
The molecular formula of BAS 03363591 is C21H27NO4.
What is the molecular weight of BAS 03363591?
The molecular weight of BAS 03363591 is 357.19 g/mol.
Where can I buy BAS 03363591?
You can request a quote for BAS 03363591 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03363591?
Yes, KEHONG BIO provides custom synthesis services for BAS 03363591 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.