BAS 00087238
TL;DR: BAS 00087238 (CAS 299449-80-2) is a chemical compound with molecular formula C23H29NO5 and molecular weight 399.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-(4-hydroxy-3-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: BAS 00087238, Isopropyl 4-(4-hydroxy-3-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, propan-2-yl 4-(4-hydroxy-3-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 4-(4-Hydroxy-3-methoxy-phenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-quinoline-3-carboxylic acid isopropyl ester, Isopropyl4-(4-hydroxy-3-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
| Molecular Formula | C23H29NO5 |
|---|---|
| Molecular Weight | 399.20 g/mol |
| LogP | 3.9564 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 399.20456 |
| Heavy Atoms | 29 |
| Complexity | 923.1959 |
Chemical Identifiers
| CAS Number | 299449-80-2 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C=C3)O)OC)C(=O)OC(C)C |
Product Overview
BAS 00087238 (CAS 299449-80-2), with molecular formula C23H29NO5 and molecular weight 399.20 g/mol. IUPAC: propan-2-yl 4-(4-hydroxy-3-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of BAS 00087238
Property Insights of BAS 00087238
The XLogP value of 3.9564 indicates that BAS 00087238 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.86 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00087238. Following Lipinski's Rule of Five, BAS 00087238 has 2 hydrogen bond donor(s) and 6 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 00087238?
The CAS number of BAS 00087238 is 299449-80-2.
What is the molecular formula of BAS 00087238?
The molecular formula of BAS 00087238 is C23H29NO5.
What is the molecular weight of BAS 00087238?
The molecular weight of BAS 00087238 is 399.20 g/mol.
Where can I buy BAS 00087238?
You can request a quote for BAS 00087238 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00087238?
Yes, KEHONG BIO provides custom synthesis services for BAS 00087238 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.