唑嘧磺隆
TL;DR: 唑嘧磺隆 (CAS 114646-05-8) is a chemical compound with molecular formula C17H17N7O5S and molecular weight 431.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
唑嘧磺隆
methyl 5-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-1-pyridin-2-ylpyrazole-4-carboxylate
Also Known As: zuomihuanglong, NC 330, NCI 851013, methyl 5-{[(4,6-dimethylpyrimidin-2-yl)carbamoyl]sulfamoyl}-1-(pyridin-2-yl)-1h-pyrazole-4-carboxylate, 1H-Pyrazole-4-carboxylic acid, 5-(((((4,6-dimethyl-2-pyrimidinyl)amino)carbonyl)amino)sulfonyl)-1-(2-pyridinyl)-, methyl ester
| Molecular Formula | C17H17N7O5S |
|---|---|
| Molecular Weight | 431.10 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 166.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 431.1012 |
| Heavy Atoms | 30 |
| Complexity | 720.0 |
Chemical Identifiers
| CAS Number | 114646-05-8 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=NN2C3=CC=CC=N3)C(=O)OC)C |
| InChIKey | KABSXJFKDZOTFH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
唑嘧磺隆 (CAS 114646-05-8), with molecular formula C17H17N7O5S and molecular weight 431.10 g/mol. IUPAC: methyl 5-[(4,6-dimethylpyrimidin-2-yl)carbamoylsulfamoyl]-1-pyridin-2-ylpyrazole-4-carboxylate.
Chemical Property Profile of 唑嘧磺隆
Property Insights of 唑嘧磺隆
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 唑嘧磺隆. The TPSA of 166.0 Ų indicates high polarity, suggesting 唑嘧磺隆 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 唑嘧磺隆 has 2 hydrogen bond donor(s) and 9 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 唑嘧磺隆?
The CAS number of 唑嘧磺隆 is 114646-05-8.
What is the molecular formula of 唑嘧磺隆?
The molecular formula of 唑嘧磺隆 is C17H17N7O5S.
What is the molecular weight of 唑嘧磺隆?
The molecular weight of 唑嘧磺隆 is 431.10 g/mol.
Where can I buy 唑嘧磺隆?
You can request a quote for 唑嘧磺隆 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 唑嘧磺隆?
Yes, KEHONG BIO provides custom synthesis services for 唑嘧磺隆 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.