BAS 01039224
TL;DR: BAS 01039224 (CAS 299449-81-3) is a chemical compound with molecular formula C23H28BrNO5 and molecular weight 477.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: BAS 01039224, propan-2-yl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, propan-2-yl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate, isopropyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, isopropyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
| Molecular Formula | C23H28BrNO5 |
|---|---|
| Molecular Weight | 477.12 g/mol |
| LogP | 4.7189 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 477.11508 |
| Heavy Atoms | 30 |
| Complexity | 974.0507 |
Chemical Identifiers
| CAS Number | 299449-81-3 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C(=C3)Br)O)OC)C(=O)OC(C)C |
Product Overview
BAS 01039224 (CAS 299449-81-3), with molecular formula C23H28BrNO5 and molecular weight 477.12 g/mol. IUPAC: propan-2-yl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of BAS 01039224
Property Insights of BAS 01039224
The XLogP value of 4.7189 indicates that BAS 01039224 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 01039224. Following Lipinski's Rule of Five, BAS 01039224 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 01039224?
The CAS number of BAS 01039224 is 299449-81-3.
What is the molecular formula of BAS 01039224?
The molecular formula of BAS 01039224 is C23H28BrNO5.
What is the molecular weight of BAS 01039224?
The molecular weight of BAS 01039224 is 477.12 g/mol.
Where can I buy BAS 01039224?
You can request a quote for BAS 01039224 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01039224?
Yes, KEHONG BIO provides custom synthesis services for BAS 01039224 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.