WV 799
TL;DR: WV 799 (CAS 73771-67-2) is a chemical compound with molecular formula C26H37Cl2NO6 and molecular weight 529.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
WV 799
2-chloroethyl-ethyl-[2-[5-methyl-2-propan-2-yl-4-(3,4,5-trimethoxybenzoyl)oxyphenoxy]ethyl]azanium chloride
Also Known As: WV 799, 5-(2-((2-Chloroethyl)ethylamino)ethoxy)carvacrol 3,4,5-trimethoxybenzylate hydrochloride, 2-chloroethyl-ethyl-[2-[5-methyl-2-propan-2-yl-4-(3,4,5-trimethoxybenzoyl)oxyphenoxy]ethyl]azanium chloride, Carvacrol, 5-(2-(N-(2-chloroethyl)-N-ethylamino)ethoxy)-, 3,4,5-trimethoxybenzylate, hydrochloride, Benzeneacetic acid, .alpha.-hydroxy-3,4,5-trimethoxy-.alpha.-phenyl-, 4-[2-[(2-chloroethyl)ethylamino]ethoxy]-2-methyl-5-(1-methylethyl)phenyl ester, hydrochloride
| Molecular Formula | C26H37Cl2NO6 |
|---|---|
| Molecular Weight | 529.20 g/mol |
| LogP | 0.89 |
| Topological Polar Surface Area | 67.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 14 |
| Exact Mass | 529.19977 |
| Heavy Atoms | 35 |
| Complexity | 580.0 |
Chemical Identifiers
| CAS Number | 73771-67-2 |
|---|---|
| SMILES | CC[NH+](CCOC1=C(C=C(C(=C1)C)OC(=O)C2=CC(=C(C(=C2)OC)OC)OC)C(C)C)CCCl.[Cl-] |
| InChIKey | LSKRMLMFOBQHHM-UHFFFAOYSA-N |
Product Overview
WV 799 (CAS 73771-67-2), with molecular formula C26H37Cl2NO6 and molecular weight 529.20 g/mol. IUPAC: 2-chloroethyl-ethyl-[2-[5-methyl-2-propan-2-yl-4-(3,4,5-trimethoxybenzoyl)oxyphenoxy]ethyl]azanium chloride.
Chemical Property Profile of WV 799
Property Insights of WV 799
The XLogP value of 0.89 suggests moderate lipophilicity, balancing water solubility and membrane permeability for WV 799. The TPSA of 67.7 Ų falls within the moderate polarity range, balancing permeability and solubility for WV 799. Following Lipinski's Rule of Five, WV 799 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of WV 799?
The CAS number of WV 799 is 73771-67-2.
What is the molecular formula of WV 799?
The molecular formula of WV 799 is C26H37Cl2NO6.
What is the molecular weight of WV 799?
The molecular weight of WV 799 is 529.20 g/mol.
Where can I buy WV 799?
You can request a quote for WV 799 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for WV 799?
Yes, KEHONG BIO provides custom synthesis services for WV 799 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.