Chromone-2-carboxylic acid, 7-methoxy-8-(4-methylpiperazin-1-ylmethyl)-, methyl ester, hydrochloride
TL;DR: Chromone-2-carboxylic acid, 7-methoxy-8-(4-methylpiperazin-1-ylmethyl)-, methyl ester, hydrochloride (CAS 100857-70-3) is a chemical compound with molecular formula C18H23ClN2O5 and molecular weight 382.12955 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 7-methoxy-8-[(4-methylpiperazin-1-yl)methyl]-4-oxochromene-2-carboxylate;hydrochloride
Also Known As: Chromone-2-carboxylic acid, 7-methoxy-8-(4-methylpiperazin-1-ylmethyl)-, methyl ester, hydrochloride, 7-Methoxy-8-(4-methylpiperazin-1-ylmethyl)chromone-2-carboxylic acid methyl ester HCl, Methyl 7-methoxy-8-[(4-methylpiperazin-1-yl)methyl]-4-oxo-4H-1-benzopyran-2-carboxylate--hydrogen chloride (1/1), methyl 7-methoxy-8-[(4-methylpiperazin-1-yl)methyl]-4-oxochromene-2-carboxylate hydrochloride
Technical Specifications
| Molecular Formula | C18H23ClN2O5 |
| Molecular Weight | 382.12955 g/mol |
| XLogP | 1.7574 |
| Topological Polar Surface Area (TPSA) | 68.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.12955 Da |
| Heavy Atoms | 26 |
| Complexity | 542.0 |
| SMILES | CN1CCN(CC1)CC2=C(C=CC3=C2OC(=CC3=O)C(=O)OC)OC.Cl |
| InChIKey | CYBRCZKXMHXOCL-UHFFFAOYSA-N |
Chemical Property Profile of Chromone-2-carboxylic acid, 7-methoxy-8-(4-methylpiperazin-1-ylmethyl)-, methyl ester, hydrochloride
Property Insights of Chromone-2-carboxylic acid, 7-methoxy-8-(4-methylpiperazin-1-ylmethyl)-, methyl ester, hydrochloride
The XLogP value of 1.7574 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chromone-2-carboxylic acid, 7-methoxy-8-(4-methylpiperazin-1-ylmethyl)-, methyl ester, hydrochloride. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Chromone-2-carboxylic acid, 7-methoxy-8-(4-methylpiperazin-1-ylmethyl)-, methyl ester, hydrochloride. Following Lipinski's Rule of Five, Chromone-2-carboxylic acid, 7-methoxy-8-(4-methylpiperazin-1-ylmethyl)-, methyl ester, hydrochloride has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Chromone-2-carboxylic acid, 7-methoxy-8-(4-methylpiperazin-1-ylmethyl)-, methyl ester, hydrochloride?
The CAS number of Chromone-2-carboxylic acid, 7-methoxy-8-(4-methylpiperazin-1-ylmethyl)-, methyl ester, hydrochloride is 100857-70-3.
What is the molecular formula of Chromone-2-carboxylic acid, 7-methoxy-8-(4-methylpiperazin-1-ylmethyl)-, methyl ester, hydrochloride?
The molecular formula of Chromone-2-carboxylic acid, 7-methoxy-8-(4-methylpiperazin-1-ylmethyl)-, methyl ester, hydrochloride is C18H23ClN2O5.
What is the molecular weight of Chromone-2-carboxylic acid, 7-methoxy-8-(4-methylpiperazin-1-ylmethyl)-, methyl ester, hydrochloride?
The molecular weight of Chromone-2-carboxylic acid, 7-methoxy-8-(4-methylpiperazin-1-ylmethyl)-, methyl ester, hydrochloride is 382.12955 g/mol.
Where can I buy Chromone-2-carboxylic acid, 7-methoxy-8-(4-methylpiperazin-1-ylmethyl)-, methyl ester, hydrochloride?
You can request a quote for Chromone-2-carboxylic acid, 7-methoxy-8-(4-methylpiperazin-1-ylmethyl)-, methyl ester, hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Chromone-2-carboxylic acid, 7-methoxy-8-(4-methylpiperazin-1-ylmethyl)-, methyl ester, hydrochloride?
Yes, CoreyChem provides custom synthesis services for Chromone-2-carboxylic acid, 7-methoxy-8-(4-methylpiperazin-1-ylmethyl)-, methyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.