BAS 00485447
TL;DR: BAS 00485447 (CAS 299451-66-4) is a chemical compound with molecular formula C18H19NO4 and molecular weight 313.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(4-hydroxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 00485447, methyl 4-(4-hydroxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, J3.392.655C, AB00086495-01, methyl 4-(4-hydroxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
| Molecular Formula | C18H19NO4 |
|---|---|
| Molecular Weight | 313.13 g/mol |
| LogP | 2.5331 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 313.1314 |
| Heavy Atoms | 23 |
| Complexity | 727.89343 |
Chemical Identifiers
| CAS Number | 299451-66-4 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)O)C(=O)OC |
Product Overview
BAS 00485447 (CAS 299451-66-4), with molecular formula C18H19NO4 and molecular weight 313.13 g/mol. IUPAC: methyl 4-(4-hydroxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 00485447
Property Insights of BAS 00485447
The XLogP value of 2.5331 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00485447. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00485447. Following Lipinski's Rule of Five, BAS 00485447 has 2 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 00485447?
The CAS number of BAS 00485447 is 299451-66-4.
What is the molecular formula of BAS 00485447?
The molecular formula of BAS 00485447 is C18H19NO4.
What is the molecular weight of BAS 00485447?
The molecular weight of BAS 00485447 is 313.13 g/mol.
Where can I buy BAS 00485447?
You can request a quote for BAS 00485447 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00485447?
Yes, KEHONG BIO provides custom synthesis services for BAS 00485447 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.