BAS 00349512
TL;DR: BAS 00349512 (CAS 5472-33-3) is a chemical compound with molecular formula C25H25NO4 and molecular weight 403.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(2-methoxyphenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 00349512, AB00086186-01, methyl 4-(2-methoxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, 4-(2-MEO-PH)-2-ME-5-OXO-7-PH-HEXAHYDRO-QUINOLINE-3-CARBOXYLIC ACID ME ESTER, methyl 4-(2-methoxyphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
| Molecular Formula | C25H25NO4 |
|---|---|
| Molecular Weight | 403.18 g/mol |
| LogP | 4.2298 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 403.17834 |
| Heavy Atoms | 30 |
| Complexity | 1051.8281 |
Chemical Identifiers
| CAS Number | 5472-33-3 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC=CC=C4OC)C(=O)OC |
Product Overview
BAS 00349512 (CAS 5472-33-3), with molecular formula C25H25NO4 and molecular weight 403.18 g/mol. IUPAC: methyl 4-(2-methoxyphenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 00349512
Property Insights of BAS 00349512
The XLogP value of 4.2298 indicates that BAS 00349512 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 00349512. Following Lipinski's Rule of Five, BAS 00349512 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00349512?
The CAS number of BAS 00349512 is 5472-33-3.
What is the molecular formula of BAS 00349512?
The molecular formula of BAS 00349512 is C25H25NO4.
What is the molecular weight of BAS 00349512?
The molecular weight of BAS 00349512 is 403.18 g/mol.
Where can I buy BAS 00349512?
You can request a quote for BAS 00349512 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00349512?
Yes, KEHONG BIO provides custom synthesis services for BAS 00349512 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.