(4Z)-3-ammoniomethyl-4-(methoxyimino)pyrrolidinium dimethanesulfonate
TL;DR: (4Z)-3-ammoniomethyl-4-(methoxyimino)pyrrolidinium dimethanesulfonate (CAS 329181-36-4) is a chemical compound with molecular formula C8H21N3O7S2 and molecular weight 335.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methanesulfonic acid;[(4Z)-4-methoxyiminopyrrolidin-3-yl]methanamine
Also Known As: Gemifloxacin Related Compound A, 1,5-Naphthalenediamine,N,N,N'-triphenyl, EC 608-799-3, methanesulfonic acid;[(4Z)-4-methoxyiminopyrrolidin-3-yl]methanamine, (Z)-3-(Aminomethyl)-4-(methoxyimino)pyrrolidine dimethanesulfonate
| Molecular Formula | C8H21N3O7S2 |
|---|---|
| Molecular Weight | 335.08 g/mol |
| LogP | -1.8251 |
| Topological Polar Surface Area | 168.38 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 335.0821 |
| Heavy Atoms | 20 |
| Complexity | 440.1999 |
Chemical Identifiers
| CAS Number | 329181-36-4 |
|---|---|
| SMILES | CO/N=C/1\CNCC1CN.CS(=O)(=O)O.CS(=O)(=O)O |
Product Overview
(4Z)-3-ammoniomethyl-4-(methoxyimino)pyrrolidinium dimethanesulfonate (CAS 329181-36-4), with molecular formula C8H21N3O7S2 and molecular weight 335.08 g/mol. IUPAC: methanesulfonic acid;[(4Z)-4-methoxyiminopyrrolidin-3-yl]methanamine.
Chemical Property Profile of (4Z)-3-ammoniomethyl-4-(methoxyimino)pyrrolidinium dimethanesulfonate
Property Insights of (4Z)-3-ammoniomethyl-4-(methoxyimino)pyrrolidinium dimethanesulfonate
The XLogP value of -1.8251 indicates that (4Z)-3-ammoniomethyl-4-(methoxyimino)pyrrolidinium dimethanesulfonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 168.38 Ų indicates high polarity, suggesting (4Z)-3-ammoniomethyl-4-(methoxyimino)pyrrolidinium dimethanesulfonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (4Z)-3-ammoniomethyl-4-(methoxyimino)pyrrolidinium dimethanesulfonate has 4 hydrogen bond donor(s) and 8 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 (4Z)-3-ammoniomethyl-4-(methoxyimino)pyrrolidinium dimethanesulfonate?
The CAS number of (4Z)-3-ammoniomethyl-4-(methoxyimino)pyrrolidinium dimethanesulfonate is 329181-36-4.
What is the molecular formula of (4Z)-3-ammoniomethyl-4-(methoxyimino)pyrrolidinium dimethanesulfonate?
The molecular formula of (4Z)-3-ammoniomethyl-4-(methoxyimino)pyrrolidinium dimethanesulfonate is C8H21N3O7S2.
What is the molecular weight of (4Z)-3-ammoniomethyl-4-(methoxyimino)pyrrolidinium dimethanesulfonate?
The molecular weight of (4Z)-3-ammoniomethyl-4-(methoxyimino)pyrrolidinium dimethanesulfonate is 335.08 g/mol.
Where can I buy (4Z)-3-ammoniomethyl-4-(methoxyimino)pyrrolidinium dimethanesulfonate?
You can request a quote for (4Z)-3-ammoniomethyl-4-(methoxyimino)pyrrolidinium dimethanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4Z)-3-ammoniomethyl-4-(methoxyimino)pyrrolidinium dimethanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for (4Z)-3-ammoniomethyl-4-(methoxyimino)pyrrolidinium dimethanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.