coumarin, 7-hydroxy-8-(piperidinomethyl)-4-propyl-, nicotinate (salt)
TL;DR: coumarin, 7-hydroxy-8-(piperidinomethyl)-4-propyl-, nicotinate (salt) (CAS 10550-24-0) is a chemical compound with molecular formula C24H28N2O5 and molecular weight 424.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-hydroxy-8-(piperidin-1-ium-1-ylmethyl)-4-propylchromen-2-one;pyridine-3-carboxylate
Also Known As: 7-Hydroxy-8-(piperidinomethyl)-4-propylcoumarin nicotinate (salt), COUMARIN, 7-HYDROXY-8-(PIPERIDINOMETHYL)-4-PROPYL-, NICOTINATE (salt), 7-hydroxy-8-(piperidin-1-ium-1-ylmethyl)-4-propylchromen-2-one; pyridine-3-carboxylate, 7-Hydroxy-8-(piperidin-1-ylmethyl)-4-propylchromen-2-one;pyridine-3-carboxylic acid, 7-Hydroxy-8-piperidin-1-ylmethyl-4-propyl-chromen-2-one; compound with nicotinic acid
| Molecular Formula | C24H28N2O5 |
|---|---|
| Molecular Weight | 424.20 g/mol |
| LogP | 1.465 |
| Topological Polar Surface Area | 107.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 424.19983 |
| Heavy Atoms | 31 |
| Complexity | 1072.515 |
Chemical Identifiers
| CAS Number | 10550-24-0 |
|---|---|
| SMILES | CCCC1=CC(=O)OC2=C1C=CC(=C2C[NH+]3CCCCC3)O.C1=CC(=CN=C1)C(=O)[O-] |
Product Overview
coumarin, 7-hydroxy-8-(piperidinomethyl)-4-propyl-, nicotinate (salt) (CAS 10550-24-0), with molecular formula C24H28N2O5 and molecular weight 424.20 g/mol. IUPAC: 7-hydroxy-8-(piperidin-1-ium-1-ylmethyl)-4-propylchromen-2-one;pyridine-3-carboxylate.
Chemical Property Profile of coumarin, 7-hydroxy-8-(piperidinomethyl)-4-propyl-, nicotinate (salt)
Property Insights of coumarin, 7-hydroxy-8-(piperidinomethyl)-4-propyl-, nicotinate (salt)
The XLogP value of 1.465 suggests moderate lipophilicity, balancing water solubility and membrane permeability for coumarin, 7-hydroxy-8-(piperidinomethyl)-4-propyl-, nicotinate (salt). The TPSA of 107.9 Ų falls within the moderate polarity range, balancing permeability and solubility for coumarin, 7-hydroxy-8-(piperidinomethyl)-4-propyl-, nicotinate (salt). Following Lipinski's Rule of Five, coumarin, 7-hydroxy-8-(piperidinomethyl)-4-propyl-, nicotinate (salt) has 2 hydrogen bond donor(s) and 6 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 coumarin, 7-hydroxy-8-(piperidinomethyl)-4-propyl-, nicotinate (salt)?
The CAS number of coumarin, 7-hydroxy-8-(piperidinomethyl)-4-propyl-, nicotinate (salt) is 10550-24-0.
What is the molecular formula of coumarin, 7-hydroxy-8-(piperidinomethyl)-4-propyl-, nicotinate (salt)?
The molecular formula of coumarin, 7-hydroxy-8-(piperidinomethyl)-4-propyl-, nicotinate (salt) is C24H28N2O5.
What is the molecular weight of coumarin, 7-hydroxy-8-(piperidinomethyl)-4-propyl-, nicotinate (salt)?
The molecular weight of coumarin, 7-hydroxy-8-(piperidinomethyl)-4-propyl-, nicotinate (salt) is 424.20 g/mol.
Where can I buy coumarin, 7-hydroxy-8-(piperidinomethyl)-4-propyl-, nicotinate (salt)?
You can request a quote for coumarin, 7-hydroxy-8-(piperidinomethyl)-4-propyl-, nicotinate (salt) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for coumarin, 7-hydroxy-8-(piperidinomethyl)-4-propyl-, nicotinate (salt)?
Yes, KEHONG BIO provides custom synthesis services for coumarin, 7-hydroxy-8-(piperidinomethyl)-4-propyl-, nicotinate (salt) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.