BAS 02169996
TL;DR: BAS 02169996 (CAS 312622-95-0) is a chemical compound with molecular formula C25H33NO6 and molecular weight 443.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-propan-2-yloxyethyl 4-(3-hydroxy-4-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: BAS 02169996, 2-isopropoxyethyl 4-(3-hydroxy-4-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, 2-(propan-2-yloxy)ethyl 4-(3-hydroxy-4-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 2-propan-2-yloxyethyl 4-(3-hydroxy-4-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
| Molecular Formula | C25H33NO6 |
|---|---|
| Molecular Weight | 443.23 g/mol |
| LogP | 3.973 |
| Topological Polar Surface Area | 94.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 443.23077 |
| Heavy Atoms | 32 |
| Complexity | 972.6443 |
Chemical Identifiers
| CAS Number | 312622-95-0 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C=C3)OC)O)C(=O)OCCOC(C)C |
Product Overview
BAS 02169996 (CAS 312622-95-0), with molecular formula C25H33NO6 and molecular weight 443.23 g/mol. IUPAC: 2-propan-2-yloxyethyl 4-(3-hydroxy-4-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of BAS 02169996
Property Insights of BAS 02169996
The XLogP value of 3.973 indicates that BAS 02169996 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.09 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02169996. Following Lipinski's Rule of Five, BAS 02169996 has 2 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 BAS 02169996?
The CAS number of BAS 02169996 is 312622-95-0.
What is the molecular formula of BAS 02169996?
The molecular formula of BAS 02169996 is C25H33NO6.
What is the molecular weight of BAS 02169996?
The molecular weight of BAS 02169996 is 443.23 g/mol.
Where can I buy BAS 02169996?
You can request a quote for BAS 02169996 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02169996?
Yes, KEHONG BIO provides custom synthesis services for BAS 02169996 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.