BAS 01404054
TL;DR: BAS 01404054 (CAS 299453-99-9) is a chemical compound with molecular formula C31H29NO4 and molecular weight 479.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-methyl-5-oxo-7-phenyl-4-(2-phenylmethoxyphenyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 01404054, methyl 4-[2-(benzyloxy)phenyl]-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, methyl 2-methyl-5-oxo-7-phenyl-4-(2-phenylmethoxyphenyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, methyl 2-methyl-5-oxo-7-phenyl-4-[2-(phenylmethoxy)phenyl]-1,4,6,7,8-pentahydr oquinoline-3-carboxylate, methyl 4-(2-(benzyloxy)phenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
| Molecular Formula | C31H29NO4 |
|---|---|
| Molecular Weight | 479.21 g/mol |
| LogP | 5.8002 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 479.20966 |
| Heavy Atoms | 36 |
| Complexity | 1341.258 |
Chemical Identifiers
| CAS Number | 299453-99-9 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC=CC=C4OCC5=CC=CC=C5)C(=O)OC |
Product Overview
BAS 01404054 (CAS 299453-99-9), with molecular formula C31H29NO4 and molecular weight 479.21 g/mol. IUPAC: methyl 2-methyl-5-oxo-7-phenyl-4-(2-phenylmethoxyphenyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 01404054
Property Insights of BAS 01404054
The XLogP value of 5.8002 indicates that BAS 01404054 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 01404054. Following Lipinski's Rule of Five, BAS 01404054 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 01404054?
The CAS number of BAS 01404054 is 299453-99-9.
What is the molecular formula of BAS 01404054?
The molecular formula of BAS 01404054 is C31H29NO4.
What is the molecular weight of BAS 01404054?
The molecular weight of BAS 01404054 is 479.21 g/mol.
Where can I buy BAS 01404054?
You can request a quote for BAS 01404054 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01404054?
Yes, KEHONG BIO provides custom synthesis services for BAS 01404054 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.