WV 027
TL;DR: WV 027 (CAS 16809-76-0) is a chemical compound with molecular formula C31H36N2O9S2 and molecular weight 644.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[2-(dimethylamino)ethoxy]-2-methyl-5-propan-2-ylphenyl] 2-aminobenzoate;naphthalene-1,5-disulfonic acid
Also Known As: WV 0027, WV 027, Carvacrol, 5-(2-(dimethylamino)ethoxy)-, anthranilate (ester), compd. with 1,5-naphthalenedisulfonic acid (1:1), [4-(2-dimethylaminoethyloxy)-2-methyl-5-propan-2-ylphenyl] 2-aminobenzoate; naphthalene-1,5-disulfonic acid, [4-[2-(dimethylamino)ethoxy]-2-methyl-5-propan-2-ylphenyl] 2-aminobenzoate;naphthalene-1,5-disulfonic acid
| Molecular Formula | C31H36N2O9S2 |
|---|---|
| Molecular Weight | 644.19 g/mol |
| LogP | 5.19342 |
| Topological Polar Surface Area | 190.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 10 |
| Exact Mass | 644.1862 |
| Heavy Atoms | 44 |
| Complexity | 890.0 |
Chemical Identifiers
| CAS Number | 16809-76-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1OC(=O)C2=CC=CC=C2N)C(C)C)OCCN(C)C.C1=CC2=C(C=CC=C2S(=O)(=O)O)C(=C1)S(=O)(=O)O |
| InChIKey | HZTINOAUYLCSAH-UHFFFAOYSA-N |
Product Overview
WV 027 (CAS 16809-76-0), with molecular formula C31H36N2O9S2 and molecular weight 644.19 g/mol. IUPAC: [4-[2-(dimethylamino)ethoxy]-2-methyl-5-propan-2-ylphenyl] 2-aminobenzoate;naphthalene-1,5-disulfonic acid.
Chemical Property Profile of WV 027
Property Insights of WV 027
The XLogP value of 5.19342 indicates that WV 027 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 190.0 Ų indicates high polarity, suggesting WV 027 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, WV 027 has 3 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of WV 027?
The CAS number of WV 027 is 16809-76-0.
What is the molecular formula of WV 027?
The molecular formula of WV 027 is C31H36N2O9S2.
What is the molecular weight of WV 027?
The molecular weight of WV 027 is 644.19 g/mol.
Where can I buy WV 027?
You can request a quote for WV 027 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for WV 027?
Yes, KEHONG BIO provides custom synthesis services for WV 027 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.