TL;DR: RefChem:268703 (CAS 42773-62-6) is a chemical compound with molecular formula C21H27ClN2O2 and molecular weight 374.17612 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3-ethoxy-2-oxo-3-phenylindol-1-yl)propyl-ethylazanium chloride
Also Known As: 1,3-Dihydro-3-ethoxy-1-(3-(ethylamino)propyl)-3-phenyl-2H-indol-2-one hydrochloride, 2H-Indol-2-one, 1,3-dihydro-3-ethoxy-1-(3-(ethylamino)propyl)-3-phenyl-, monohydrochloride, 3-(3-ethoxy-2-oxo-3-phenylindol-1-yl)propyl-ethylazanium chloride, 2H-INDOL-2-ONE, 1,3-DIHYDRO-3-ETHOXY-1-(3-(ETHYLAMINO)PROPYL)-3-PHENYL-, MONOHYD
| Molecular Formula | C21H27ClN2O2 |
| Molecular Weight | 374.17612 g/mol |
| XLogP | -0.71 |
| Topological Polar Surface Area (TPSA) | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 374.17612 Da |
| Heavy Atoms | 26 |
| Complexity | 436.0 |
| SMILES | CC[NH2+]CCCN1C2=CC=CC=C2C(C1=O)(C3=CC=CC=C3)OCC.[Cl-] |
| InChIKey | GHCPLPJQENAPJU-UHFFFAOYSA-N |
The XLogP value of -0.71 indicates that RefChem:268703 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.2 Ų, RefChem:268703 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:268703 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:268703 is 42773-62-6.
The molecular formula of RefChem:268703 is C21H27ClN2O2.
The molecular weight of RefChem:268703 is 374.17612 g/mol.
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