WIN 3415
TL;DR: WIN 3415 (CAS 100347-82-8) is a chemical compound with molecular formula C18H25N2O7P and molecular weight 412.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-amino-2-phenylmethoxybenzoyl)oxyethyl-dimethylazanium;dihydrogen phosphate
Also Known As: WIN 3415, 4-Amino-2-(benzyloxy)-benzoic acid 2-(dimethylamino)ethyl ester hydrogen phosphate, Benzoic acid, 4-amino-2-(benzyloxy)-, 2-(dimethylamino)ethyl ester, hydrogen phosphate, 2-(4-Amino-2-phenylmethoxybenzoyl)oxyethyl-dimethylazanium; dihydrogenphosphate, 2-{[4-amino-2-(benzyloxy)benzoyl]oxy}-n,n-dimethylethanaminium dihydrogen phosphate
| Molecular Formula | C18H25N2O7P |
|---|---|
| Molecular Weight | 412.14 g/mol |
| LogP | -0.41 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 412.13992 |
| Heavy Atoms | 28 |
| Complexity | 406.0 |
Chemical Identifiers
| CAS Number | 100347-82-8 |
|---|---|
| SMILES | C[NH+](C)CCOC(=O)C1=C(C=C(C=C1)N)OCC2=CC=CC=C2.OP(=O)(O)[O-] |
| InChIKey | FKRDKHRBWSKOHP-UHFFFAOYSA-N |
Product Overview
WIN 3415 (CAS 100347-82-8), with molecular formula C18H25N2O7P and molecular weight 412.14 g/mol. IUPAC: 2-(4-amino-2-phenylmethoxybenzoyl)oxyethyl-dimethylazanium;dihydrogen phosphate.
Chemical Property Profile of WIN 3415
Property Insights of WIN 3415
The XLogP value of -0.41 indicates that WIN 3415 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 147.0 Ų indicates high polarity, suggesting WIN 3415 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, WIN 3415 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 WIN 3415?
The CAS number of WIN 3415 is 100347-82-8.
What is the molecular formula of WIN 3415?
The molecular formula of WIN 3415 is C18H25N2O7P.
What is the molecular weight of WIN 3415?
The molecular weight of WIN 3415 is 412.14 g/mol.
Where can I buy WIN 3415?
You can request a quote for WIN 3415 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for WIN 3415?
Yes, KEHONG BIO provides custom synthesis services for WIN 3415 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.