帕马洛尔硫酸盐
TL;DR: 帕马洛尔硫酸盐 (CAS 59954-01-7) is a chemical compound with molecular formula C32H54N4O12S and molecular weight 718.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
帕马洛尔硫酸盐
bis(methyl N-[2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]ethyl]carbamate);sulfuric acid
Also Known As: PAMATOLOL SULFATE, Pamatolol sulphate, Pamatolol sulfate [USAN], Pamatolol sulfate (USAN), H 104/08
| Molecular Formula | C32H54N4O12S |
|---|---|
| Molecular Weight | 718.35 g/mol |
| LogP | 1.99 |
| Topological Polar Surface Area | 243.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 20 |
| Exact Mass | 718.3459 |
| Heavy Atoms | 49 |
| Complexity | 386.0 |
Chemical Identifiers
| CAS Number | 59954-01-7 |
|---|---|
| SMILES | CC(C)NCC(COC1=CC=C(C=C1)CCNC(=O)OC)O.CC(C)NCC(COC1=CC=C(C=C1)CCNC(=O)OC)O.OS(=O)(=O)O |
| InChIKey | OUXGIOLQOYAZLS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
帕马洛尔硫酸盐 (CAS 59954-01-7), with molecular formula C32H54N4O12S and molecular weight 718.35 g/mol. IUPAC: bis(methyl N-[2-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]ethyl]carbamate);sulfuric acid.
Chemical Property Profile of 帕马洛尔硫酸盐
Property Insights of 帕马洛尔硫酸盐
The XLogP value of 1.99 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 帕马洛尔硫酸盐. The TPSA of 243.0 Ų indicates high polarity, suggesting 帕马洛尔硫酸盐 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 帕马洛尔硫酸盐 has 8 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 帕马洛尔硫酸盐?
The CAS number of 帕马洛尔硫酸盐 is 59954-01-7.
What is the molecular formula of 帕马洛尔硫酸盐?
The molecular formula of 帕马洛尔硫酸盐 is C32H54N4O12S.
What is the molecular weight of 帕马洛尔硫酸盐?
The molecular weight of 帕马洛尔硫酸盐 is 718.35 g/mol.
Where can I buy 帕马洛尔硫酸盐?
You can request a quote for 帕马洛尔硫酸盐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 帕马洛尔硫酸盐?
Yes, KEHONG BIO provides custom synthesis services for 帕马洛尔硫酸盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.