甲硫酸喹脲
TL;DR: 甲硫酸喹脲 (CAS 135-14-8) is a chemical compound with molecular formula C23H26N4O9S2 and molecular weight 566.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲硫酸喹脲
1,3-bis(1-methylquinolin-1-ium-6-yl)urea;methyl sulfate
Also Known As: Pyroplasmin, Zothelone, Acaprin, Baburan, Pirevan
| Molecular Formula | C23H26N4O9S2 |
|---|---|
| Molecular Weight | 566.11 g/mol |
| LogP | 1.47 |
| Topological Polar Surface Area | 199.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 566.11414 |
| Heavy Atoms | 38 |
| Complexity | 547.0 |
Chemical Identifiers
| CAS Number | 135-14-8 |
|---|---|
| SMILES | C[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)NC3=CC4=C(C=C3)[N+](=CC=C4)C.COS(=O)(=O)[O-].COS(=O)(=O)[O-] |
| InChIKey | BOMUADPKDXMXIH-UHFFFAOYSA-M |
Product Overview
甲硫酸喹脲 (CAS 135-14-8), with molecular formula C23H26N4O9S2 and molecular weight 566.11 g/mol. IUPAC: 1,3-bis(1-methylquinolin-1-ium-6-yl)urea;methyl sulfate.
Chemical Property Profile of 甲硫酸喹脲
Property Insights of 甲硫酸喹脲
The XLogP value of 1.47 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 甲硫酸喹脲. The TPSA of 199.0 Ų indicates high polarity, suggesting 甲硫酸喹脲 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 甲硫酸喹脲 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 甲硫酸喹脲?
The CAS number of 甲硫酸喹脲 is 135-14-8.
What is the molecular formula of 甲硫酸喹脲?
The molecular formula of 甲硫酸喹脲 is C23H26N4O9S2.
What is the molecular weight of 甲硫酸喹脲?
The molecular weight of 甲硫酸喹脲 is 566.11 g/mol.
Where can I buy 甲硫酸喹脲?
You can request a quote for 甲硫酸喹脲 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲硫酸喹脲?
Yes, KEHONG BIO provides custom synthesis services for 甲硫酸喹脲 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.