BAS 00380700
TL;DR: BAS 00380700 (CAS 294197-61-8) is a chemical compound with molecular formula C28H31NO4 and molecular weight 445.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2,7,7-trimethyl-5-oxo-4-(2-phenylmethoxyphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate
Also Known As: BAS 00380700, ethyl 4-[2-(benzyloxy)phenyl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, ethyl 4-(2-(benzyloxy)phenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, F0265-0004, ethyl 2,7,7-trimethyl-5-oxo-4-(2-phenylmethoxyphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate
| Molecular Formula | C28H31NO4 |
|---|---|
| Molecular Weight | 445.23 g/mol |
| LogP | 5.4327 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 445.2253 |
| Heavy Atoms | 33 |
| Complexity | 1127.5962 |
Chemical Identifiers
| CAS Number | 294197-61-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3OCC4=CC=CC=C4)C(=O)CC(C2)(C)C)C |
Product Overview
BAS 00380700 (CAS 294197-61-8), with molecular formula C28H31NO4 and molecular weight 445.23 g/mol. IUPAC: ethyl 2,7,7-trimethyl-5-oxo-4-(2-phenylmethoxyphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate.
Chemical Property Profile of BAS 00380700
Property Insights of BAS 00380700
The XLogP value of 5.4327 indicates that BAS 00380700 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00380700. Following Lipinski's Rule of Five, BAS 00380700 has 1 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 BAS 00380700?
The CAS number of BAS 00380700 is 294197-61-8.
What is the molecular formula of BAS 00380700?
The molecular formula of BAS 00380700 is C28H31NO4.
What is the molecular weight of BAS 00380700?
The molecular weight of BAS 00380700 is 445.23 g/mol.
Where can I buy BAS 00380700?
You can request a quote for BAS 00380700 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00380700?
Yes, KEHONG BIO provides custom synthesis services for BAS 00380700 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.