RefChem:195200
TL;DR: RefChem:195200 (CAS 39701-33-2) is a chemical compound with molecular formula C30H36N2O7S and molecular weight 568.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-(diethylamino)-9-(2-methoxycarbonylphenyl)xanthen-3-ylidene]-diethylazanium;methyl sulfate
Also Known As: Xanthylium, 3,6-bis(diethylamino)-9-(2-(methoxycarbonyl)phenyl)-, methyl sulfate, Xanthylium, 3,6-bis(diethylamino)-9-(2-(methoxycarbonyl)phenyl)-, methyl sulfate (1:1), Xanthylium, 3,6-bis(diethylamino)-9-[2-(methoxycarbonyl)phenyl]-, methyl sulfate, Xanthylium, 3,6-bis(diethylamino)-9-[2-(methoxycarbonyl)phenyl]-, methyl sulfate (1:1), 3,6-Bis(diethylamino)-9-[2-(methoxycarbonyl)phenyl]xanthen-10-ium methyl sulfate
| Molecular Formula | C30H36N2O7S |
|---|---|
| Molecular Weight | 568.22 g/mol |
| LogP | 4.74 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 568.2243 |
| Heavy Atoms | 40 |
| Complexity | 917.0 |
Chemical Identifiers
| CAS Number | 39701-33-2 |
|---|---|
| SMILES | CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=CC=CC=C4C(=O)OC.COS(=O)(=O)[O-] |
| InChIKey | MOVYXPWEFBTHDN-UHFFFAOYSA-M |
Product Overview
RefChem:195200 (CAS 39701-33-2), with molecular formula C30H36N2O7S and molecular weight 568.22 g/mol. IUPAC: [6-(diethylamino)-9-(2-methoxycarbonylphenyl)xanthen-3-ylidene]-diethylazanium;methyl sulfate.
Chemical Property Profile of RefChem:195200
Property Insights of RefChem:195200
The XLogP value of 4.74 indicates that RefChem:195200 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:195200. Following Lipinski's Rule of Five, RefChem:195200 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:195200?
The CAS number of RefChem:195200 is 39701-33-2.
What is the molecular formula of RefChem:195200?
The molecular formula of RefChem:195200 is C30H36N2O7S.
What is the molecular weight of RefChem:195200?
The molecular weight of RefChem:195200 is 568.22 g/mol.
Where can I buy RefChem:195200?
You can request a quote for RefChem:195200 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:195200?
Yes, KEHONG BIO provides custom synthesis services for RefChem:195200 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.