TL;DR: RefChem:1068932 (CAS 157596-33-3) is a chemical compound with molecular formula C19H23ClN2O and molecular weight 330.1499 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(Z)-N-(2-pyrrolidin-1-ylethoxy)-1,2-dihydrocyclopenta[a]naphthalen-3-imine;hydrochloride
Also Known As: 1,2-Dihydro-3H-benz(e)inden-3-one O-(2-(1-pyrrolidinyl)ethyl)oxime monohydrochloride, 3H-Benz(e)inden-3-one, 1,2-dihydro-, O-(2-(1-pyrrolidinyl)ethyl)oxime, monohydrochloride, 3-(2-(N-Pyrrolidinyl)ethoxyimino)-2,3-dihydro-1H-benz(e)indene hydrochloride, N-(2-pyrrolidin-1-ylethoxy)-1,2-dihydrocyclopenta[a]naphthalen-3-imine hydrochloride
| Molecular Formula | C19H23ClN2O |
| Molecular Weight | 330.1499 g/mol |
| XLogP | 4.0243 |
| Topological Polar Surface Area (TPSA) | 24.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.1499 Da |
| Heavy Atoms | 23 |
| Complexity | 402.0 |
| SMILES | C1CCN(C1)CCO/N=C\2/CCC3=C2C=CC4=CC=CC=C34.Cl |
| InChIKey | BAVSYORKYQXZNT-BLTQDSCZSA-N |
The XLogP value of 4.0243 indicates that RefChem:1068932 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.8 Ų, RefChem:1068932 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1068932 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of RefChem:1068932 is 157596-33-3.
The molecular formula of RefChem:1068932 is C19H23ClN2O.
The molecular weight of RefChem:1068932 is 330.1499 g/mol.
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