TL;DR: 9-Dimethylamino-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one (CAS 140413-15-6) is a chemical compound with molecular formula C15H15N3O2 and molecular weight 269.11642 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
9-(dimethylamino)-6-methylpyrido[2,3-b][1,5]benzoxazepin-5-one
Also Known As: 9diMeAm-6Me-PBOA-5one, 9-Dimethylamino-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one, 9-(dimethylamino)-6-methylpyrido[2,3-b][1,5]benzoxazepin-5-one, Pyrido[2,3-b][1,5]benzoxazepin-5(6H)-one,9-(dimethylamino)-6-methyl-, 9-(dimethylamino)-6-methyl-pyrido[2,3-b][1,5]benzoxazepin-5-one
| Molecular Formula | C15H15N3O2 |
| Molecular Weight | 269.11642 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 45.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 269.11642 Da |
| Heavy Atoms | 20 |
| Complexity | 374.0 |
| SMILES | CN1C2=C(C=C(C=C2)N(C)C)OC3=C(C1=O)C=CC=N3 |
| InChIKey | HUESBOPSZSWDRA-UHFFFAOYSA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-Dimethylamino-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one. With a topological polar surface area (TPSA) of 45.7 Ų, 9-Dimethylamino-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Dimethylamino-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 9-Dimethylamino-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one is 140413-15-6.
The molecular formula of 9-Dimethylamino-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one is C15H15N3O2.
The molecular weight of 9-Dimethylamino-6-methyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one is 269.11642 g/mol.
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