A3014/0127049
TL;DR: A3014/0127049 (CAS 433254-52-5) is a chemical compound with molecular formula C26H33NO4 and molecular weight 423.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cycloheptyl 4-(3-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: A3014/0127049, cycloheptyl 4-(3-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, CYCLOHEPTYL 4-(3-HYDROXYPHENYL)-2,7,7-TRIMETHYL-5-OXO-1,4,5,6,7,8-HEXAHYDRO-3-QUINOLINECARBOXYLATE, cycloheptyl 4-(3-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
| Molecular Formula | C26H33NO4 |
|---|---|
| Molecular Weight | 423.24 g/mol |
| LogP | 5.2622 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 423.24097 |
| Heavy Atoms | 31 |
| Complexity | 947.90857 |
Chemical Identifiers
| CAS Number | 433254-52-5 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=CC=C3)O)C(=O)OC4CCCCCC4 |
Product Overview
A3014/0127049 (CAS 433254-52-5), with molecular formula C26H33NO4 and molecular weight 423.24 g/mol. IUPAC: cycloheptyl 4-(3-hydroxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of A3014/0127049
Property Insights of A3014/0127049
The XLogP value of 5.2622 indicates that A3014/0127049 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for A3014/0127049. Following Lipinski's Rule of Five, A3014/0127049 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3014/0127049?
The CAS number of A3014/0127049 is 433254-52-5.
What is the molecular formula of A3014/0127049?
The molecular formula of A3014/0127049 is C26H33NO4.
What is the molecular weight of A3014/0127049?
The molecular weight of A3014/0127049 is 423.24 g/mol.
Where can I buy A3014/0127049?
You can request a quote for A3014/0127049 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3014/0127049?
Yes, KEHONG BIO provides custom synthesis services for A3014/0127049 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.