Methyl 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-4-quinolinecarboxylate
TL;DR: Methyl 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-4-quinolinecarboxylate (CAS 67987-12-6) is a chemical compound with molecular formula C17H19BrN2O3 and molecular weight 378.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-bromo-6-hydroxy-8-(piperidin-1-ylmethyl)quinoline-4-carboxylate
Also Known As: Methyl 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-4-quinolinecarboxylate, 4-Quinolinecarboxylic acid, 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-, methyl ester, methyl 5-bromo-6-hydroxy-8-(piperidin-1-ylmethyl)quinoline-4-carboxylate, Methyl 5-bromo-6-hydroxy-8-[(piperidin-1-yl)methyl]quinoline-4-carboxylate
| Molecular Formula | C17H19BrN2O3 |
|---|---|
| Molecular Weight | 378.06 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 62.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 378.05792 |
| Heavy Atoms | 23 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 67987-12-6 |
|---|---|
| SMILES | COC(=O)C1=C2C(=C(C=C(C2=NC=C1)CN3CCCCC3)O)Br |
| InChIKey | MSTXOSAFZLYOLK-UHFFFAOYSA-N |
Product Overview
Methyl 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-4-quinolinecarboxylate (CAS 67987-12-6), with molecular formula C17H19BrN2O3 and molecular weight 378.06 g/mol. IUPAC: methyl 5-bromo-6-hydroxy-8-(piperidin-1-ylmethyl)quinoline-4-carboxylate.
Chemical Property Profile of Methyl 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-4-quinolinecarboxylate
Property Insights of Methyl 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-4-quinolinecarboxylate
The XLogP value of 3.1 indicates that Methyl 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-4-quinolinecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-4-quinolinecarboxylate. Following Lipinski's Rule of Five, Methyl 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-4-quinolinecarboxylate 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 Methyl 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-4-quinolinecarboxylate?
The CAS number of Methyl 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-4-quinolinecarboxylate is 67987-12-6.
What is the molecular formula of Methyl 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-4-quinolinecarboxylate?
The molecular formula of Methyl 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-4-quinolinecarboxylate is C17H19BrN2O3.
What is the molecular weight of Methyl 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-4-quinolinecarboxylate?
The molecular weight of Methyl 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-4-quinolinecarboxylate is 378.06 g/mol.
Where can I buy Methyl 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-4-quinolinecarboxylate?
You can request a quote for Methyl 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-4-quinolinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-4-quinolinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-4-quinolinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.