TL;DR: 4-(4-Methylbenzoselenoyl)morpholine (CAS 139546-54-6) is a chemical compound with molecular formula C12H15NOSe and molecular weight 269.0319 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-methylphenyl)-morpholin-4-ylmethaneselone
Also Known As: 4-(4-methylbenzoselenoyl)morpholine, 4-(4-Methylselenobenzoyl)morpholine, Morpholin-4-yl-p-tolyl-methaneselone, (4-methylphenyl)-morpholin-4-ylmethaneselone, Morpholine, 4-[(4-methylphenyl)selenoxomethyl]-
| Molecular Formula | C12H15NOSe |
| Molecular Weight | 269.0319 g/mol |
| XLogP | 0.97372 |
| Topological Polar Surface Area (TPSA) | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 269.0319 Da |
| Heavy Atoms | 15 |
| Complexity | 218.0 |
| SMILES | CC1=CC=C(C=C1)C(=[Se])N2CCOCC2 |
| InChIKey | OWZWESZMCMQGSW-UHFFFAOYSA-N |
The XLogP value of 0.97372 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Methylbenzoselenoyl)morpholine. With a topological polar surface area (TPSA) of 12.5 Ų, 4-(4-Methylbenzoselenoyl)morpholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Methylbenzoselenoyl)morpholine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-(4-Methylbenzoselenoyl)morpholine is 139546-54-6.
The molecular formula of 4-(4-Methylbenzoselenoyl)morpholine is C12H15NOSe.
The molecular weight of 4-(4-Methylbenzoselenoyl)morpholine is 269.0319 g/mol.
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