TL;DR: Pyrido(2,1-c)(1,4)oxazine, octahydro-3-phenyl-3-(phenylmethoxy)-, hydrochloride (CAS 126807-00-9) is a chemical compound with molecular formula C21H26ClNO2 and molecular weight 359.1652 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-phenyl-3-phenylmethoxy-4,6,7,8,9,9a-hexahydro-1H-pyrido[2,1-c][1,4]oxazine;hydrochloride
Also Known As: Octahydro-3-phenyl-3-(phenylmethoxy)pyrido(2,1-c)(1,4)oxazine hydrochloride, Pyrido(2,1-c)(1,4)oxazine, octahydro-3-phenyl-3-(phenylmethoxy)-, hydrochloride, 3-(Benzyloxy)-3-phenyloctahydropyrido[2,1-c][1,4]oxazine--hydrogen chloride (1/1), 3-phenyl-3-phenylmethoxy-4,6,7,8,9,9a-hexahydro-1H-pyrido[2,1-c][1,4]oxazine hydrochloride
| Molecular Formula | C21H26ClNO2 |
| Molecular Weight | 359.1652 g/mol |
| XLogP | 4.3627 |
| Topological Polar Surface Area (TPSA) | 21.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 359.1652 Da |
| Heavy Atoms | 25 |
| Complexity | 389.0 |
| SMILES | C1CCN2CC(OCC2C1)(C3=CC=CC=C3)OCC4=CC=CC=C4.Cl |
| InChIKey | FGPVJXYMXWYANF-UHFFFAOYSA-N |
The XLogP value of 4.3627 indicates that Pyrido(2,1-c)(1,4)oxazine, octahydro-3-phenyl-3-(phenylmethoxy)-, 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-phenyl-3-(phenylmethoxy)-, 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-phenyl-3-(phenylmethoxy)-, 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-phenyl-3-(phenylmethoxy)-, hydrochloride is 126807-00-9.
The molecular formula of Pyrido(2,1-c)(1,4)oxazine, octahydro-3-phenyl-3-(phenylmethoxy)-, hydrochloride is C21H26ClNO2.
The molecular weight of Pyrido(2,1-c)(1,4)oxazine, octahydro-3-phenyl-3-(phenylmethoxy)-, hydrochloride is 359.1652 g/mol.
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