BAS 00410931
TL;DR: BAS 00410931 (CAS 299453-47-7) is a chemical compound with molecular formula C24H28BrNO5 and molecular weight 489.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclohexyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 00410931, cyclohexyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, cyclohexyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, cyclohexyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-methyl-5-oxo-1,4,6,7,8-pent ahydroquinoline-3-carboxylate, cyclohexyl 4-[3-bromo-4-hydroxy-5-(methyloxy)phenyl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
| Molecular Formula | C24H28BrNO5 |
|---|---|
| Molecular Weight | 489.12 g/mol |
| LogP | 5.0071 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 489.11508 |
| Heavy Atoms | 31 |
| Complexity | 974.4269 |
Chemical Identifiers
| CAS Number | 299453-47-7 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C(=C3)Br)O)OC)C(=O)OC4CCCCC4 |
Product Overview
BAS 00410931 (CAS 299453-47-7), with molecular formula C24H28BrNO5 and molecular weight 489.12 g/mol. IUPAC: cyclohexyl 4-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 00410931
Property Insights of BAS 00410931
The XLogP value of 5.0071 indicates that BAS 00410931 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 00410931. Following Lipinski's Rule of Five, BAS 00410931 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00410931?
The CAS number of BAS 00410931 is 299453-47-7.
What is the molecular formula of BAS 00410931?
The molecular formula of BAS 00410931 is C24H28BrNO5.
What is the molecular weight of BAS 00410931?
The molecular weight of BAS 00410931 is 489.12 g/mol.
Where can I buy BAS 00410931?
You can request a quote for BAS 00410931 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00410931?
Yes, KEHONG BIO provides custom synthesis services for BAS 00410931 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.