TL;DR: 2-Aminomethyl-10-methyl-dibenz(b,f)(1,4)oxazepin-11-(10H)-one (CAS 140412-86-8) is a chemical compound with molecular formula C15H14N2O2 and molecular weight 254.10553 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-(aminomethyl)-5-methylbenzo[b][1,4]benzoxazepin-6-one
Also Known As: 2NH2CH2-10Me-DBOA-11one, 2-Aminomethyl-10-methyl-dibenz(b,f)(1,4)oxazepin-11-(10H)-one, 8-(aminomethyl)-5-methylbenzo[b][1,4]benzoxazepin-6-one, 8-(aminomethyl)-5-methyl-benzo[b][1,4]benzoxazepin-6-one, 2-Aminomethyl-10-methyldibenz[b,f][1,4]oxazepin-11(10H)-one
| Molecular Formula | C15H14N2O2 |
| Molecular Weight | 254.10553 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 55.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 254.10553 Da |
| Heavy Atoms | 19 |
| Complexity | 347.0 |
| SMILES | CN1C2=CC=CC=C2OC3=C(C1=O)C=C(C=C3)CN |
| InChIKey | HBFCKIASRQZNBZ-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Aminomethyl-10-methyl-dibenz(b,f)(1,4)oxazepin-11-(10H)-one. With a topological polar surface area (TPSA) of 55.6 Ų, 2-Aminomethyl-10-methyl-dibenz(b,f)(1,4)oxazepin-11-(10H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Aminomethyl-10-methyl-dibenz(b,f)(1,4)oxazepin-11-(10H)-one 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 2-Aminomethyl-10-methyl-dibenz(b,f)(1,4)oxazepin-11-(10H)-one is 140412-86-8.
The molecular formula of 2-Aminomethyl-10-methyl-dibenz(b,f)(1,4)oxazepin-11-(10H)-one is C15H14N2O2.
The molecular weight of 2-Aminomethyl-10-methyl-dibenz(b,f)(1,4)oxazepin-11-(10H)-one is 254.10553 g/mol.
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