TL;DR: [[Amino-(4-bromophenyl)methylidene]amino] morpholine-4-carboxylate (CAS 1426943-56-7) is a chemical compound with molecular formula C12H14BrN3O3 and molecular weight 327.02185 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[[amino-(4-bromophenyl)methylidene]amino] morpholine-4-carboxylate
Also Known As: [[amino-(4-bromophenyl)methylidene]amino] morpholine-4-carboxylate
| Molecular Formula | C12H14BrN3O3 |
| Molecular Weight | 327.02185 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 77.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 327.02185 Da |
| Heavy Atoms | 19 |
| Complexity | 337.0 |
| SMILES | C1COCCN1C(=O)ON=C(C2=CC=C(C=C2)Br)N |
| InChIKey | CCXSXGXXIGHRHJ-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [[Amino-(4-bromophenyl)methylidene]amino] morpholine-4-carboxylate. The TPSA of 77.2 Ų falls within the moderate polarity range, balancing permeability and solubility for [[Amino-(4-bromophenyl)methylidene]amino] morpholine-4-carboxylate. Following Lipinski's Rule of Five, [[Amino-(4-bromophenyl)methylidene]amino] morpholine-4-carboxylate has 1 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 [[Amino-(4-bromophenyl)methylidene]amino] morpholine-4-carboxylate is 1426943-56-7.
The molecular formula of [[Amino-(4-bromophenyl)methylidene]amino] morpholine-4-carboxylate is C12H14BrN3O3.
The molecular weight of [[Amino-(4-bromophenyl)methylidene]amino] morpholine-4-carboxylate is 327.02185 g/mol.
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