TL;DR: Pyrido(2,1-c)(1,4)oxazine, octahydro-3-ethoxy-3-phenyl-, hydrochloride (CAS 126806-96-0) is a chemical compound with molecular formula C16H24ClNO2 and molecular weight 297.14957 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-ethoxy-3-phenyl-4,6,7,8,9,9a-hexahydro-1H-pyrido[2,1-c][1,4]oxazine;hydrochloride
Also Known As: Octahydro-3-ethoxy-3-phenylpyrido(2,1-c)(1,4)oxazine hydrochloride, Pyrido(2,1-c)(1,4)oxazine, octahydro-3-ethoxy-3-phenyl-, hydrochloride, 3-ethoxy-3-phenyl-4,6,7,8,9,9a-hexahydro-1H-pyrido[2,1-c][1,4]oxazine hydrochloride, 3-Ethoxy-3-phenyloctahydropyrido[2,1-c][1,4]oxazine--hydrogen chloride (1/1)
| Molecular Formula | C16H24ClNO2 |
| Molecular Weight | 297.14957 g/mol |
| XLogP | 3.1824 |
| Topological Polar Surface Area (TPSA) | 21.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.14957 Da |
| Heavy Atoms | 20 |
| Complexity | 290.0 |
| SMILES | CCOC1(CN2CCCCC2CO1)C3=CC=CC=C3.Cl |
| InChIKey | SIMNFXQIWHYWBS-UHFFFAOYSA-N |
The XLogP value of 3.1824 indicates that Pyrido(2,1-c)(1,4)oxazine, octahydro-3-ethoxy-3-phenyl-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.7 Ų, Pyrido(2,1-c)(1,4)oxazine, octahydro-3-ethoxy-3-phenyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrido(2,1-c)(1,4)oxazine, octahydro-3-ethoxy-3-phenyl-, hydrochloride 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 Pyrido(2,1-c)(1,4)oxazine, octahydro-3-ethoxy-3-phenyl-, hydrochloride is 126806-96-0.
The molecular formula of Pyrido(2,1-c)(1,4)oxazine, octahydro-3-ethoxy-3-phenyl-, hydrochloride is C16H24ClNO2.
The molecular weight of Pyrido(2,1-c)(1,4)oxazine, octahydro-3-ethoxy-3-phenyl-, hydrochloride is 297.14957 g/mol.
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