BAS 01051811
TL;DR: BAS 01051811 (CAS 330674-85-6) is a chemical compound with molecular formula C31H34BrNO5 and molecular weight 579.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclohexyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 01051811, cyclohexyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, cyclohexyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, cyclohexyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, cyclohexyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,6, 7,8-pentahydroquinoline-3-carboxylate
| Molecular Formula | C31H34BrNO5 |
|---|---|
| Molecular Weight | 579.16 g/mol |
| LogP | 6.7909 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 579.16205 |
| Heavy Atoms | 38 |
| Complexity | 1292.8481 |
Chemical Identifiers
| CAS Number | 330674-85-6 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC(=C2C(=O)OC5CCCCC5)C)Br)O |
Product Overview
BAS 01051811 (CAS 330674-85-6), with molecular formula C31H34BrNO5 and molecular weight 579.16 g/mol. IUPAC: cyclohexyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 01051811
Property Insights of BAS 01051811
The XLogP value of 6.7909 indicates that BAS 01051811 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 01051811. Following Lipinski's Rule of Five, BAS 01051811 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 01051811?
The CAS number of BAS 01051811 is 330674-85-6.
What is the molecular formula of BAS 01051811?
The molecular formula of BAS 01051811 is C31H34BrNO5.
What is the molecular weight of BAS 01051811?
The molecular weight of BAS 01051811 is 579.16 g/mol.
Where can I buy BAS 01051811?
You can request a quote for BAS 01051811 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01051811?
Yes, KEHONG BIO provides custom synthesis services for BAS 01051811 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.