TL;DR: AVE-8063 (hydrochloride) (CAS 162705-22-8) is a chemical compound with molecular formula C18H22ClNO4 and molecular weight 351.12375 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methoxy-5-[(Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]aniline;hydrochloride
Also Known As: AVE-8063 (hydrochloride), AC 7739, Benzenamine, 2-methoxy-5-((1Z)-2-(3,4,5-trimethoxyphenyl)ethenyl)-, hydrochloride, Benzenamine, 2-methoxy-5-((1Z)-2-(3,4,5-trimethoxyphenyl)ethenyl)-, hydrochloride (1:1), Benzenamine, 2-methoxy-5-(2-(3,4,5-trimethoxyphenyl)ethenyl)-, hydrochloride, (Z)-
| Molecular Formula | C18H22ClNO4 |
| Molecular Weight | 351.12375 g/mol |
| XLogP | 3.8954 |
| Topological Polar Surface Area (TPSA) | 62.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 351.12375 Da |
| Heavy Atoms | 24 |
| Complexity | 362.0 |
| SMILES | COC1=C(C=C(C=C1)/C=C\C2=CC(=C(C(=C2)OC)OC)OC)N.Cl |
| InChIKey | SCJGXQSJGQUCFA-YSMBQZINSA-N |
The XLogP value of 3.8954 indicates that AVE-8063 (hydrochloride) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.9 Ų falls within the moderate polarity range, balancing permeability and solubility for AVE-8063 (hydrochloride). Following Lipinski's Rule of Five, AVE-8063 (hydrochloride) has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of AVE-8063 (hydrochloride) is 162705-22-8.
The molecular formula of AVE-8063 (hydrochloride) is C18H22ClNO4.
The molecular weight of AVE-8063 (hydrochloride) is 351.12375 g/mol.
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