1H-Pyrazole-4-carboxylic acid, 5-amino-1-(7-methylpyrimido(5,4-c)cinnolin-4-yl)-3-(methylthio)-, ethyl ester
TL;DR: 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(7-methylpyrimido(5,4-c)cinnolin-4-yl)-3-(methylthio)-, ethyl ester (CAS 159418-11-8) is a chemical compound with molecular formula C18H17N7O2S and molecular weight 395.11646 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 5-amino-1-(7-methylpyrimido[5,4-c]cinnolin-4-yl)-3-methylsulfanylpyrazole-4-carboxylate
Also Known As: 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(7-methylpyrimido(5,4-c)cinnolin-4-yl)-3-(methylthio)-, ethyl ester, Pyrimido[5,4-c]cinnoline,1H-pyrazole-4-carboxylic acid deriv., ethyl 5-amino-1-(7-methylpyrimido[5,4-c]cinnolin-4-yl)-3-methylsulfanylpyrazole-4-carboxylate, 1-(8-Methyl-2,4,9,10-tetraazaphenanthren-1-yl)-3-(methylthio)-5-amino-1H-pyrazole-4-carboxylic acid ethyl ester, 1H-Pyrazole-4-carboxylicacid, 5-amino-1-(7-methylpyrimido[5,4-c]cinnolin-4-yl)-3-(methylthio)-, ethylester
Technical Specifications
| Molecular Formula | C18H17N7O2S |
| Molecular Weight | 395.11646 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 147.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 395.11646 Da |
| Heavy Atoms | 28 |
| Complexity | 570.0 |
| SMILES | CCOC(=O)C1=C(N(N=C1SC)C2=NC=NC3=C2N=NC4=C(C=CC=C43)C)N |
| InChIKey | KBFOHWYBDVFUCZ-UHFFFAOYSA-N |
Chemical Property Profile of 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(7-methylpyrimido(5,4-c)cinnolin-4-yl)-3-(methylthio)-, ethyl ester
Property Insights of 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(7-methylpyrimido(5,4-c)cinnolin-4-yl)-3-(methylthio)-, ethyl ester
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(7-methylpyrimido(5,4-c)cinnolin-4-yl)-3-(methylthio)-, ethyl ester. The TPSA of 147.0 Ų indicates high polarity, suggesting 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(7-methylpyrimido(5,4-c)cinnolin-4-yl)-3-(methylthio)-, ethyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(7-methylpyrimido(5,4-c)cinnolin-4-yl)-3-(methylthio)-, ethyl ester has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(7-methylpyrimido(5,4-c)cinnolin-4-yl)-3-(methylthio)-, ethyl ester?
The CAS number of 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(7-methylpyrimido(5,4-c)cinnolin-4-yl)-3-(methylthio)-, ethyl ester is 159418-11-8.
What is the molecular formula of 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(7-methylpyrimido(5,4-c)cinnolin-4-yl)-3-(methylthio)-, ethyl ester?
The molecular formula of 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(7-methylpyrimido(5,4-c)cinnolin-4-yl)-3-(methylthio)-, ethyl ester is C18H17N7O2S.
What is the molecular weight of 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(7-methylpyrimido(5,4-c)cinnolin-4-yl)-3-(methylthio)-, ethyl ester?
The molecular weight of 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(7-methylpyrimido(5,4-c)cinnolin-4-yl)-3-(methylthio)-, ethyl ester is 395.11646 g/mol.
Where can I buy 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(7-methylpyrimido(5,4-c)cinnolin-4-yl)-3-(methylthio)-, ethyl ester?
You can request a quote for 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(7-methylpyrimido(5,4-c)cinnolin-4-yl)-3-(methylthio)-, ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(7-methylpyrimido(5,4-c)cinnolin-4-yl)-3-(methylthio)-, ethyl ester?
Yes, CoreyChem provides custom synthesis services for 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(7-methylpyrimido(5,4-c)cinnolin-4-yl)-3-(methylthio)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.